[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl] 3-azanyl-5-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: [2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl] 3-azanyl-5-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: [2-(4-ethoxyphenyl)-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-(4-ethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethoxyphenyl)-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-p-phenetyl-ethyl) ester Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)COC(=O)C2=C(C3=CC(=C(N=C3S2)C4=CC=CC=C4)C)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)COC(=O)C2=C(C3=CC(=C(N=C3S2)C4=CC=CC=C4)C)N

InChI

InChI=1S/C25H22N2O4S/c1-3-30-18-11-9-16(10-12-18)20(28)14-31-25(29)23-21(26)19-13-15(2)22(27-24(19)32-23)17-7-5-4-6-8-17/h4-13H,3,14,26H2,1-2H3