methyl 1-[2-oxidanylidene-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]indole-3-carboxylate CAS Name: 1-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]indole-3-carboxylic acid methyl ester Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCC4=C(C3C5=CC=CC=C5)C=CS4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCC4=C(C3C5=CC=CC=C5)C=CS4

InChI

InChI=1S/C25H22N2O3S/c1-30-25(29)20-15-26(21-10-6-5-9-18(20)21)16-23(28)27-13-11-22-19(12-14-31-22)24(27)17-7-3-2-4-8-17/h2-10,12,14-15,24H,11,13,16H2,1H3