propyl 4-(2-chlorophenyl)-2-[(3-methyl-4-nitro-phenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: propyl 4-(2-chlorophenyl)-2-[(3-methyl-4-nitro-phenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: propyl 4-(2-chlorophenyl)-2-[(3-methyl-4-nitro-benzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(2-chlorophenyl)-2-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 4-(2-chlorophenyl)-2-[(3-methyl-4-nitrobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-[(3-methyl-4-nitro-benzoyl)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=CC=C2Cl)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

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