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

Systemtic Name: ethyl 6-oxidanylidene-7-phenyl-3-[(phenylmethyl)amino]thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 3-(benzylamino)-6-oxo-7-phenyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 6-oxo-7-phenyl-3-[(phenylmethyl)amino]-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(benzylamino)-6-oxo-7-phenylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-(benzylamino)-6-keto-7-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C23H20N2O3S MolecularWeight: 404.4815

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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)NCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N(C(=O)C=C2)C3=CC=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O3S/c1-2-28-23(27)21-20(24-15-16-9-5-3-6-10-16)18-13-14-19(26)25(22(18)29-21)17-11-7-4-8-12-17/h3-14,24H,2,15H2,1H3