ethyl 2-[(4-methylphenyl)carbonylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-methylphenyl)carbonylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-methylbenzoyl)amino]-4-(3-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[(4-methylphenyl)-oxomethyl]amino]-4-(3-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-methylbenzoyl)amino]-4-(3-nitrophenyl)thiophene-3-carboxylate Traditional Name: 4-(3-nitrophenyl)-2-(p-toluoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H18N2O5S/c1-3-28-21(25)18-17(15-5-4-6-16(11-15)23(26)27)12-29-20(18)22-19(24)14-9-7-13(2)8-10-14/h4-12H,3H2,1-2H3,(H,22,24)