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

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 3-azanyl-5-methyl-6-phenyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: [2-(3-nitrophenyl)-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-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-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-(3-nitrophenyl)ethyl] ester Formula: C23H17N3O5S MolecularWeight: 447.46318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C(=C1)C(=C(S2)C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C2C(=C1)C(=C(S2)C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N)C4=CC=CC=C4

InChI

InChI=1S/C23H17N3O5S/c1-13-10-17-19(24)21(32-22(17)25-20(13)14-6-3-2-4-7-14)23(28)31-12-18(27)15-8-5-9-16(11-15)26(29)30/h2-11H,12,24H2,1H3