methyl 5-[(3-chlorophenyl)carbamoyl]-2-(cyclohexylcarbonylamino)-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-[(3-chlorophenyl)carbamoyl]-2-(cyclohexylcarbonylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-[(3-chlorophenyl)carbamoyl]-2-(cyclohexanecarbonylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-[(3-chloroanilino)-oxomethyl]-2-[[cyclohexyl(oxo)methyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(3-chlorophenyl)carbamoyl]-2-(cyclohexanecarbonylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-[(3-chlorophenyl)carbamoyl]-2-(cyclohexanecarbonylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H23ClN2O4S MolecularWeight: 434.93632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2CCCCC2)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2CCCCC2)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN2O4S/c1-12-16(21(27)28-2)20(24-18(25)13-7-4-3-5-8-13)29-17(12)19(26)23-15-10-6-9-14(22)11-15/h6,9-11,13H,3-5,7-8H2,1-2H3,(H,23,26)(H,24,25)