(phenylmethyl) 3-azanyl-4-(4-ethoxyphenyl)-6-oxidanylidene-5,7-dihydro-4H-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: (phenylmethyl) 3-azanyl-4-(4-ethoxyphenyl)-6-oxidanylidene-5,7-dihydro-4H-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: benzyl 3-amino-4-(4-ethoxyphenyl)-6-oxo-5,7-dihydro-4H-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-4-(4-ethoxyphenyl)-6-oxo-5,7-dihydro-4H-thieno[2,3-b]pyridine-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-amino-4-(4-ethoxyphenyl)-6-oxo-5,7-dihydro-4H-thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-6-keto-4-p-phenetyl-5,7-dihydro-4H-thieno[2,3-b]pyridine-2-carboxylic acid benzyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CC(=O)NC3=C2C(=C(S3)C(=O)OCC4=CC=CC=C4)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CC(=O)NC3=C2C(=C(S3)C(=O)OCC4=CC=CC=C4)N

InChI

InChI=1S/C23H22N2O4S/c1-2-28-16-10-8-15(9-11-16)17-12-18(26)25-22-19(17)20(24)21(30-22)23(27)29-13-14-6-4-3-5-7-14/h3-11,17H,2,12-13,24H2,1H3,(H,25,26)