ethyl 2-[(2,4-dichlorophenyl)carbonylamino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2,4-dichlorophenyl)carbonylamino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(2,4-dichlorobenzoyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-5-methyl-4-(4-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2,4-dichlorobenzoyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[(2,4-dichlorobenzoyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H16Cl2N2O5S MolecularWeight: 479.33314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16Cl2N2O5S/c1-3-30-21(27)18-17(12-4-7-14(8-5-12)25(28)29)11(2)31-20(18)24-19(26)15-9-6-13(22)10-16(15)23/h4-10H,3H2,1-2H3,(H,24,26)