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

Systemtic Name: ethyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-5-(cyclopentylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-chloro-3-nitro-benzoyl)amino]-5-(cyclopentylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-5-[(cyclopentylamino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chloro-3-nitrobenzoyl)amino]-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)amino]-5-(cyclopentylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H22ClN3O6S MolecularWeight: 479.93388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2CCCC2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2CCCC2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H22ClN3O6S/c1-3-31-21(28)16-11(2)17(19(27)23-13-6-4-5-7-13)32-20(16)24-18(26)12-8-9-14(22)15(10-12)25(29)30/h8-10,13H,3-7H2,1-2H3,(H,23,27)(H,24,26)