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844499-71-4 molecular structure
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4-hydroxy-3-[4-(2-hydroxyphenyl)phenyl]-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carbonitrile

ChemBase ID: 73175
Molecular Formular: C20H12N2O3S
Molecular Mass: 360.38588
Monoisotopic Mass: 360.05686325
SMILES and InChIs

SMILES:
c1(ccc(cc1)c1csc2c1c(c(c(=O)[nH]2)C#N)O)c1ccccc1O
Canonical SMILES:
N#Cc1c(=O)[nH]c2c(c1O)c(cs2)c1ccc(cc1)c1ccccc1O
InChI:
InChI=1S/C20H12N2O3S/c21-9-14-18(24)17-15(10-26-20(17)22-19(14)25)12-7-5-11(6-8-12)13-3-1-2-4-16(13)23/h1-8,10,23H,(H2,22,24,25)
InChIKey:
CTESJDQKVOEUOY-UHFFFAOYSA-N

Cite this record

CBID:73175 http://www.chembase.cn/molecule-73175.html

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