propyl 4-(4-chlorophenyl)-5-methyl-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: propyl 4-(4-chlorophenyl)-5-methyl-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: propyl 4-(4-chlorophenyl)-5-methyl-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-5-methyl-2-[[(4-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 4-(4-chlorophenyl)-5-methyl-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-5-methyl-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylic acid propyl ester Formula: C22H19ClN2O5S MolecularWeight: 458.91466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN2O5S/c1-3-12-30-22(27)19-18(14-4-8-16(23)9-5-14)13(2)31-21(19)24-20(26)15-6-10-17(11-7-15)25(28)29/h4-11H,3,12H2,1-2H3,(H,24,26)