ethyl 4-(methoxymethyl)-6-methyl-3-[(4-nitrophenyl)carbonylamino]thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 4-(methoxymethyl)-6-methyl-3-[(4-nitrophenyl)carbonylamino]thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 4-(methoxymethyl)-6-methyl-3-[(4-nitrobenzoyl)amino]thieno[2,3-b]pyridine-2-carboxylate CAS Name: 4-(methoxymethyl)-6-methyl-3-[[(4-nitrophenyl)-oxomethyl]amino]-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(methoxymethyl)-6-methyl-3-[(4-nitrobenzoyl)amino]thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 4-(methoxymethyl)-6-methyl-3-[(4-nitrobenzoyl)amino]thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C20H19N3O6S MolecularWeight: 429.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2COC)C)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2COC)C)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O6S/c1-4-29-20(25)17-16(15-13(10-28-3)9-11(2)21-19(15)30-17)22-18(24)12-5-7-14(8-6-12)23(26)27/h5-9H,4,10H2,1-3H3,(H,22,24)