N-[(4-chlorophenyl)methyl]-2-(3-methoxyprop-1-ynyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carbothioamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-(3-methoxyprop-1-ynyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carbothioamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-(3-methoxyprop-1-ynyl)-4-thioxo-7H-thieno[2,3-b]pyridine-5-carbothioamide CAS Name: N-[(4-chlorophenyl)methyl]-2-(3-methoxyprop-1-ynyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carbothioamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-(3-methoxyprop-1-ynyl)-4-sulfanylidene-7H-thieno[2,3-b]pyridine-5-carbothioamide Traditional Name: N-(4-chlorobenzyl)-2-(3-methoxyprop-1-ynyl)-4-thioxo-7H-thieno[2,3-b]pyridine-5-carbothioamide Formula: C19H15ClN2OS3 MolecularWeight: 418.9832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC#CC1=CC2=C(S1)NC=C(C2=S)C(=S)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

COCC#CC1=CC2=C(S1)NC=C(C2=S)C(=S)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H15ClN2OS3/c1-23-8-2-3-14-9-15-17(24)16(11-22-19(15)26-14)18(25)21-10-12-4-6-13(20)7-5-12/h4-7,9,11H,8,10H2,1H3,(H,21,25)(H,22,24)