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918505-84-7 molecular structure
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N-(3-{5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbonyl}-2,4-difluorophenyl)propane-1-sulfonamide

ChemBase ID: 4652
Molecular Formular: C17H14ClF2N3O3S
Molecular Mass: 413.8261664
Monoisotopic Mass: 413.04124644
SMILES and InChIs

SMILES:
O=S(=O)(CCC)Nc1c(F)c(c(cc1)F)C(=O)c1c[nH]c2c1cc(cn2)Cl
Canonical SMILES:
CCCS(=O)(=O)Nc1ccc(c(c1F)C(=O)c1c[nH]c2c1cc(Cl)cn2)F
InChI:
InChI=1S/C17H14ClF2N3O3S/c1-2-5-27(25,26)23-13-4-3-12(19)14(15(13)20)16(24)11-8-22-17-10(11)6-9(18)7-21-17/h3-4,6-8,23H,2,5H2,1H3,(H,21,22)
InChIKey:
YZDJQTHVDDOVHR-UHFFFAOYSA-N

Cite this record

CBID:4652 http://www.chembase.cn/molecule-4652.html

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