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

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-(3-oxidanylpropyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-(3-hydroxypropyl)-4-thioxo-7H-thieno[2,3-b]pyridine-5-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-2-(3-hydroxypropyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-(3-hydroxypropyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carboxamide Traditional Name: N-(4-chlorobenzyl)-2-(3-hydroxypropyl)-4-thioxo-7H-thieno[2,3-b]pyridine-5-carboxamide Formula: C18H17ClN2O2S2 MolecularWeight: 392.92278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN2O2S2/c19-12-5-3-11(4-6-12)9-20-17(23)15-10-21-18-14(16(15)24)8-13(25-18)2-1-7-22/h3-6,8,10,22H,1-2,7,9H2,(H,20,23)(H,21,24)