Chembase list of 866358 unique molecular structures

4-(chloromethyl)-2-(4-chlorophenyl)-1H-imidazole hydrochloride

$$$$ Data

M. F.

C10H9Cl3N2

Suppliers	Catalog Number
Enamine	EN300-108678

Database	Data ID
PubChem	71756230

M. W.

263.55086

CAS

Similarity

N/A

ID: 238752

3-[(oxolan-2-ylmethyl)sulfamoyl]benzoic acid

$$$$ Data

M. F.

C12H15NO5S

Suppliers	Catalog Number
Enamine	EN300-10868

Database	Data ID
PubChem	2952881

M. W.

285.3162

CAS

Similarity

N/A

ID: 238753

1-methyl-1H,4H,5H,6H,7H-pyrrolo[2,3-c]pyridine hydrochloride

$$$$ Data

M. F.

C8H13ClN2

Suppliers	Catalog Number
Enamine	EN300-108680

Database	Data ID
PubChem	71756231

M. W.

172.65522

CAS

Similarity

N/A

ID: 238754

4-chloro-2,6-bis(propan-2-yl)pyrimidine

$$$$ Data

M. F.

C10H15ClN2

Suppliers	Catalog Number
Enamine	EN300-108681

Database	Data ID
PubChem	43557629

M. W.

198.6925

CAS

Similarity

N/A

ID: 238755

2,4-di-tert-butyl-6-chloropyrimidine

$$$$ Data

M. F.

C12H19ClN2

Suppliers	Catalog Number
Enamine	EN300-108682

Database	Data ID
PubChem	11368138

M. W.

226.74566

CAS

Similarity

N/A

ID: 238756

4-(piperazine-1-sulfonyl)-2λ⁴,1,3-benzothiadiazole

$$$$ Data

M. F.

C10H12N4O2S2

Suppliers	Catalog Number
Enamine	EN300-10869

Database	Data ID
PubChem	931485

M. W.

284.35788

CAS

Similarity

N/A

ID: 238757

4-(4-tert-butylbenzenesulfonamido)benzoic acid

$$$$ Data

M. F.

C17H19NO4S

Suppliers	Catalog Number
Enamine	EN300-10870

Database	Data ID
PubChem	2960409

M. W.

333.40206

CAS

Similarity

N/A

ID: 238758

3-(2,4-dimethylbenzenesulfonamido)propanoic acid

$$$$ Data

M. F.

C11H15NO4S

Suppliers	Catalog Number
Enamine	EN300-10871

Database	Data ID
PubChem	2366623

M. W.

257.3061

CAS

Similarity

N/A

ID: 238759

4-aminothiane-4-carboxylic acid

$$$$ Data

M. F.

C6H11NO2S

Suppliers	Catalog Number
Enamine	EN300-108712
A&J Pharmtech	AJA-O31434

Database	Data ID
PubChem	336313

M. W.

161.22204

CAS

39124-16-8

Similarity

N/A

ID: 238760

4-(tert-butylsulfamoyl)benzoic acid

$$$$ Data

M. F.

C11H15NO4S

Suppliers	Catalog Number
Enamine	EN300-10872

Database	Data ID
PubChem	1133436

M. W.

257.3061

CAS

99987-05-0

Similarity

N/A

ID: 238761

4-[(3-methylpiperidin-1-yl)sulfonyl]benzoic acid

$$$$ Data

M. F.

C13H17NO4S

Suppliers	Catalog Number
Enamine	EN300-10873

Database	Data ID
PubChem	2770974

M. W.

283.34338

CAS

Similarity

N/A

ID: 238762

(5-methyl-1,3-oxazol-2-yl)methanol

$$$$ Data

M. F.

C5H7NO2

Suppliers	Catalog Number
Enamine	EN300-108747
A&J Pharmtech	AJA-O37898

Database	Data ID
PubChem	22081028

M. W.

113.11458

CAS

888022-42-2

Similarity

N/A

ID: 238763

N-(4-aminophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

$$$$ Data

M. F.

C14H14N2O4S

Suppliers	Catalog Number
Enamine	EN300-10875

Database	Data ID
PubChem	2546193

M. W.

306.33696

CAS

Similarity

N/A

ID: 238764

2-phenylmethanesulfonamidoacetic acid

$$$$ Data

M. F.

C9H11NO4S

Suppliers	Catalog Number
Enamine	EN300-10876

Database	Data ID
PubChem	227303

M. W.

229.25294

CAS

6966-44-5

Similarity

N/A

ID: 238765

2,4-dimethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate

$$$$ Data

M. F.

C10H12BrNO4

Suppliers	Catalog Number
Enamine	EN300-10877

Database	Data ID
PubChem	2492675

M. W.

290.11058

CAS

Similarity

N/A

ID: 238766

1-(4-bromophenyl)propan-1-amine

$$$$ Data

M. F.

C9H12BrN

Suppliers	Catalog Number
Enamine	EN300-10878

Database	Data ID
PubChem	3432895

M. W.

214.10228

CAS

74877-09-1

Similarity

N/A

ID: 238767

5-(piperazin-1-yl)thiophene-2-carbaldehyde

$$$$ Data

M. F.

C9H12N2OS

Suppliers	Catalog Number
Enamine	EN300-10879

Database	Data ID
PubChem	2463177

M. W.

196.26938

CAS

Similarity

N/A

ID: 238768

2-chloro-1-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]ethan-1-on...

$$$$ Data

M. F.

C15H17ClN2O4

Suppliers	Catalog Number
Enamine	EN300-10880

Database	Data ID
PubChem	3386403

M. W.

324.75948

CAS

Similarity

N/A

ID: 238769

4-(1-aminoethyl)-N,N-diethylbenzene-1-sulfonamide

$$$$ Data

M. F.

C12H20N2O2S

Suppliers	Catalog Number
Enamine	EN300-10881

Database	Data ID
PubChem	3809717

M. W.

256.3644

CAS

Similarity

N/A

ID: 238770

5-(1-chloroethyl)-3-(4-methoxyphenyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C11H11ClN2O2

Suppliers	Catalog Number
Enamine	EN300-108810

Database	Data ID
PubChem	23184363

M. W.

238.67024

CAS

Similarity

N/A

ID: 238771

5-(chloromethyl)-3-(4-fluoro-3-methylphenyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C10H8ClFN2O

Suppliers	Catalog Number
Enamine	EN300-108811

Database	Data ID
PubChem	16778631

M. W.

226.6347232

CAS

Similarity

N/A

ID: 238772

5-(chloromethyl)-3-(3,4-difluorophenyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C9H5ClF2N2O

Suppliers	Catalog Number
Enamine	EN300-108812

Database	Data ID
PubChem	43658623

M. W.

230.5986064

CAS

Similarity

N/A

ID: 238773

5-(chloromethyl)-3-(3-methoxy-4-methylphenyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C11H11ClN2O2

Suppliers	Catalog Number
Enamine	EN300-108813

Database	Data ID
PubChem	71756232

M. W.

238.67024

CAS

Similarity

N/A

ID: 238774

5-(chloromethyl)-3-(3,5-dimethylphenoxymethyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C12H13ClN2O2

Suppliers	Catalog Number
Enamine	EN300-108814

Database	Data ID
PubChem	71756233

M. W.

252.69682

CAS

Similarity

N/A

ID: 238775

5-(chloromethyl)-3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C12H13ClN2O4

Suppliers	Catalog Number
Enamine	EN300-108815

Database	Data ID
PubChem	4606397

M. W.

284.69562

CAS

Similarity

N/A

ID: 238776

5-(chloromethyl)-3-(3,4,5-trifluorophenyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C9H4ClF3N2O

Suppliers	Catalog Number
Enamine	EN300-108817

Database	Data ID
PubChem	61650719

M. W.

248.5890696

CAS

Similarity

N/A

ID: 238777

(2E)-3-[3-(2-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid

$$$$ Data

M. F.

C19H16N2O3

Suppliers	Catalog Number
Enamine	EN300-10882

Database	Data ID
PubChem	5799492

M. W.

320.34194

CAS

Similarity

N/A

ID: 238778

4-(aminomethyl)-N-(4-fluorophenyl)benzene-1-sulfonamide

$$$$ Data

M. F.

C13H13FN2O2S

Suppliers	Catalog Number
Enamine	EN300-108820

Database	Data ID
PubChem	16643196

M. W.

280.3179232

CAS

Similarity

N/A

ID: 238779

4-chloro-2-hydroxybenzonitrile

$$$$ Data

M. F.

C7H4ClNO

Suppliers	Catalog Number
Enamine	EN300-108821
Bide Pharmatech	BD210613

Database	Data ID
PubChem	3442789

M. W.

153.56576

CAS

30818-28-1

Similarity

N/A

ID: 238780

3-(4-methyl-4H-1,2,4-triazol-3-yl)propan-1-amine

$$$$ Data

M. F.

C6H12N4

Suppliers	Catalog Number
Enamine	EN300-108822

Database	Data ID
PubChem	62694254

M. W.

140.18628

CAS

Similarity

N/A

ID: 238781

N-(2-methoxyethyl)-4-methylbenzene-1-carboximidamide hydrochloride

$$$$ Data

M. F.

C11H17ClN2O

Suppliers	Catalog Number
Enamine	EN300-108823

Database	Data ID
PubChem	71756234

M. W.

228.71848

CAS

Similarity

N/A

ID: 238782

[1-(2-aminophenyl)piperidin-4-yl]methanol

$$$$ Data

M. F.

C12H18N2O

Suppliers	Catalog Number
Enamine	EN300-108824

Database	Data ID
PubChem	43133156

M. W.

206.28412

CAS

Similarity

N/A

ID: 238783

2-bromo-5-(difluoromethyl)-1,3,4-thiadiazole

$$$$ Data

M. F.

C3HBrF2N2S

Suppliers	Catalog Number
Enamine	EN300-108825

Database	Data ID
PubChem	63384015

M. W.

215.0192464

CAS

Similarity

N/A

ID: 238784

(5-methyl-1H-1,2,4-triazol-3-yl)methanol

$$$$ Data

M. F.

C4H7N3O

Suppliers	Catalog Number
ChemBridge	4043449
Enamine	EN300-108826

Database	Data ID
PubChem	22099238

M. W.

113.11788

CAS

1183178-48-4

Similarity

N/A

ID: 238785

(1R)-2,2,2-trifluoro-1-(4-methyl-1,3-thiazol-2-yl)ethan-1-ol

$$$$ Data

M. F.

C6H6F3NOS

Suppliers	Catalog Number
Enamine	EN300-108827

Database	Data ID
PubChem	9267875

M. W.

197.1781496

CAS

Similarity

N/A

ID: 238786

2-(4-iodophenoxymethyl)benzamide

$$$$ Data

M. F.

C14H12INO2

Suppliers	Catalog Number
Enamine	EN300-108828

Database	Data ID
PubChem	17808100

M. W.

353.15505

CAS

Similarity

N/A

ID: 238787

3-(4-iodophenoxymethyl)benzamide

$$$$ Data

M. F.

C14H12INO2

Suppliers	Catalog Number
Enamine	EN300-108829

Database	Data ID
PubChem	47173105

M. W.

353.15505

CAS

Similarity

N/A

ID: 238788

2-chloro-1-[4-(methylsulfanyl)phenyl]ethan-1-one

$$$$ Data

M. F.

C9H9ClOS

Suppliers	Catalog Number
Enamine	EN300-10883

Database	Data ID
PubChem	3864514

M. W.

200.68516

CAS

Similarity

N/A

ID: 238789

4-ethyl-2,3-dihydro-1H-imidazol-2-one

$$$$ Data

M. F.

C5H8N2O

Suppliers	Catalog Number
Enamine	EN300-108830

Database	Data ID
PubChem	15567528

M. W.

112.12982

CAS

Similarity

N/A

ID: 238790

4-ethyl-1H-imidazole-2-thiol

$$$$ Data

M. F.

C5H8N2S

Suppliers	Catalog Number
Enamine	EN300-108834

Database	Data ID
PubChem	20259031

M. W.

128.19542

CAS

Similarity

N/A

ID: 238791

2-(3-methyl-4-nitrophenyl)acetonitrile

$$$$ Data

M. F.

C9H8N2O2

Suppliers	Catalog Number
Enamine	EN300-108835

Database	Data ID
PubChem	14147337

M. W.

176.17202

CAS

Similarity

N/A

ID: 238792

N-cyano-N-methyl-3-(methylsulfanyl)aniline

$$$$ Data

M. F.

C9H10N2S

Suppliers	Catalog Number
Enamine	EN300-108836

Database	Data ID
PubChem	10654914

M. W.

178.2541

CAS

Similarity

N/A

ID: 238793

5-bromo-4-hydroxy-6-methylpyridine-3-carboxylic acid

$$$$ Data

M. F.

C7H6BrNO3

Suppliers	Catalog Number
Enamine	EN300-108838

Database	Data ID
PubChem	18329967

M. W.

232.03144

CAS

Similarity

N/A

ID: 238794

5-chloro-2,3-dihydro-1-benzofuran-3-amine hydrochloride

$$$$ Data

M. F.

C8H9Cl2NO

Suppliers	Catalog Number
Enamine	EN300-108839

Database	Data ID
PubChem	53408125

M. W.

206.06916

CAS

Similarity

N/A

ID: 238795

6-(chloromethyl)-1-(4-chlorophenyl)-3-methyl-1H,4H,7H-pyrazolo[3,4-b]pyridin-4-o...

$$$$ Data

M. F.

C14H11Cl2N3O

Suppliers	Catalog Number
Enamine	EN300-10884

Database	Data ID
PubChem	3861963

M. W.

308.16264

CAS

Similarity

N/A

ID: 238796

1-chloro-4-methoxybutan-2-one

$$$$ Data

M. F.

C5H9ClO2

Suppliers	Catalog Number
Enamine	EN300-108840

Database	Data ID
PubChem	14068888

M. W.

136.57676

CAS

Similarity

N/A

ID: 238797

4,6-di-tert-butylpyrimidin-2-amine

$$$$ Data

M. F.

C12H21N3

Suppliers	Catalog Number
Enamine	EN300-108841

Database	Data ID
PubChem	12709882

M. W.

207.31524

CAS

Similarity

N/A

ID: 238798

5-tert-butyl-1,3-oxazole-2-thiol

$$$$ Data

M. F.

C7H11NOS

Suppliers	Catalog Number
Enamine	EN300-108842

Database	Data ID
PubChem	12251579

M. W.

157.23334

CAS

Similarity

N/A

ID: 238799

[2-(4-chlorophenyl)-1H-imidazol-4-yl]methanol

$$$$ Data

M. F.

C10H9ClN2O

Suppliers	Catalog Number
Enamine	EN300-108844

Database	Data ID
PubChem	57368647

M. W.

208.64426

CAS

Similarity

N/A

ID: 238800

5-benzyloxolan-2-one

$$$$ Data

M. F.

C11H12O2

Suppliers	Catalog Number
Enamine	EN300-108845

Database	Data ID
PubChem	13256416

M. W.

176.21178

CAS

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified