propan-2-yl 2-[[2-(4-chlorophenyl)-3-methyl-quinolin-4-yl]carbonylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[[2-(4-chlorophenyl)-3-methyl-quinolin-4-yl]carbonylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: isopropyl 2-[[2-(4-chlorophenyl)-3-methyl-quinoline-4-carbonyl]amino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[[2-(4-chlorophenyl)-3-methyl-4-quinolinyl]-oxomethyl]amino]-5-[diethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-(4-chlorophenyl)-3-methylquinoline-4-carbonyl]amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-chlorophenyl)-3-methyl-quinoline-4-carbonyl]amino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid isopropyl ester Formula: C31H32ClN3O4S MolecularWeight: 578.12148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl)C)C(=O)OC(C)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl)C)C(=O)OC(C)C)C

InChI

InChI=1S/C31H32ClN3O4S/c1-7-35(8-2)30(37)27-19(6)25(31(38)39-17(3)4)29(40-27)34-28(36)24-18(5)26(20-13-15-21(32)16-14-20)33-23-12-10-9-11-22(23)24/h9-17H,7-8H2,1-6H3,(H,34,36)