ethyl 3-(3-methylphenyl)sulfanyl-6-oxidanylidene-7-phenyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 3-(3-methylphenyl)sulfanyl-6-oxidanylidene-7-phenyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 3-(m-tolylsulfanyl)-6-oxo-7-phenyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-[(3-methylphenyl)thio]-6-oxo-7-phenyl-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-methylphenyl)sulfanyl-6-oxo-7-phenylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 6-keto-3-(m-tolylthio)-7-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C23H19NO3S2 MolecularWeight: 421.53186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N(C(=O)C=C2)C3=CC=CC=C3)SC4=CC=CC(=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N(C(=O)C=C2)C3=CC=CC=C3)SC4=CC=CC(=C4)C

InChI

InChI=1S/C23H19NO3S2/c1-3-27-23(26)21-20(28-17-11-7-8-15(2)14-17)18-12-13-19(25)24(22(18)29-21)16-9-5-4-6-10-16/h4-14H,3H2,1-2H3