ethyl 4-(4-chlorophenyl)-2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[(4-morpholino-3-nitro-benzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[(4-morpholino-3-nitro-benzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H22ClN3O6S MolecularWeight: 515.96598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H22ClN3O6S/c1-2-34-24(30)21-18(15-3-6-17(25)7-4-15)14-35-23(21)26-22(29)16-5-8-19(20(13-16)28(31)32)27-9-11-33-12-10-27/h3-8,13-14H,2,9-12H2,1H3,(H,26,29)