N-[(4-chlorophenyl)methyl]-2-(hydroxymethyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-(hydroxymethyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-(hydroxymethyl)-4-thioxo-7H-thieno[2,3-b]pyridine-5-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-2-(hydroxymethyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-(hydroxymethyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carboxamide Traditional Name: N-(4-chlorobenzyl)-2-methylol-4-thioxo-7H-thieno[2,3-b]pyridine-5-carboxamide Formula: C16H13ClN2O2S2 MolecularWeight: 364.86962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C2=S)C=C(S3)CO)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C2=S)C=C(S3)CO)Cl

InChI

InChI=1S/C16H13ClN2O2S2/c17-10-3-1-9(2-4-10)6-18-15(21)13-7-19-16-12(14(13)22)5-11(8-20)23-16/h1-5,7,20H,6,8H2,(H,18,21)(H,19,22)