[2-(3-methylphenyl)-2-oxidanylidene-ethyl] 3-azanyl-5-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: [2-(3-methylphenyl)-2-oxidanylidene-ethyl] 3-azanyl-5-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: [2-(m-tolyl)-2-oxo-ethyl] 3-amino-5-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-5-methyl-6-phenyl-2-thieno[2,3-b]pyridinecarboxylic acid [2-(3-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methylphenyl)-2-oxoethyl] 3-amino-5-methyl-6-phenylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-5-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid [2-keto-2-(m-tolyl)ethyl] ester Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)COC(=O)C2=C(C3=CC(=C(N=C3S2)C4=CC=CC=C4)C)N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)COC(=O)C2=C(C3=CC(=C(N=C3S2)C4=CC=CC=C4)C)N

InChI

InChI=1S/C24H20N2O3S/c1-14-7-6-10-17(11-14)19(27)13-29-24(28)22-20(25)18-12-15(2)21(26-23(18)30-22)16-8-4-3-5-9-16/h3-12H,13,25H2,1-2H3