ethyl 5-aminocarbonyl-2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-2-[(4-chloro-3-nitro-benzoyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-2-[(4-chloro-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[(4-chloro-3-nitro-benzoyl)amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H14ClN3O6S MolecularWeight: 411.81686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O6S/c1-3-26-16(23)11-7(2)12(13(18)21)27-15(11)19-14(22)8-4-5-9(17)10(6-8)20(24)25/h4-6H,3H2,1-2H3,(H2,18,21)(H,19,22)