4-(4-chlorophenyl)-3-(cyclohexylmethylcarbamoylamino)thiophene-2-carboxylic acid

Systemtic Name: 4-(4-chlorophenyl)-3-(cyclohexylmethylcarbamoylamino)thiophene-2-carboxylic acid Openeye Name: 4-(4-chlorophenyl)-3-(cyclohexylmethylcarbamoylamino)thiophene-2-carboxylic acid CAS Name: 4-(4-chlorophenyl)-3-[[(cyclohexylmethylamino)-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 4-(4-chlorophenyl)-3-(cyclohexylmethylcarbamoylamino)thiophene-2-carboxylic acid Traditional Name: 4-(4-chlorophenyl)-3-(cyclohexylmethylcarbamoylamino)-2-thenoic acid Formula: C19H21ClN2O3S MolecularWeight: 392.89964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)NC2=C(SC=C2C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1CCC(CC1)CNC(=O)NC2=C(SC=C2C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C19H21ClN2O3S/c20-14-8-6-13(7-9-14)15-11-26-17(18(23)24)16(15)22-19(25)21-10-12-4-2-1-3-5-12/h6-9,11-12H,1-5,10H2,(H,23,24)(H2,21,22,25)