ethyl 2-[(3-chlorophenyl)carbonylamino]-5-(cyclohexylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(3-chlorophenyl)carbonylamino]-5-(cyclohexylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(3-chlorobenzoyl)amino]-5-(cyclohexylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3-chlorophenyl)-oxomethyl]amino]-5-[(cyclohexylamino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-chlorobenzoyl)amino]-5-(cyclohexylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[(3-chlorobenzoyl)amino]-5-(cyclohexylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H25ClN2O4S MolecularWeight: 448.9629

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2CCCCC2)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2CCCCC2)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H25ClN2O4S/c1-3-29-22(28)17-13(2)18(20(27)24-16-10-5-4-6-11-16)30-21(17)25-19(26)14-8-7-9-15(23)12-14/h7-9,12,16H,3-6,10-11H2,1-2H3,(H,24,27)(H,25,26)