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

Systemtic Name: propan-2-yl 5-[[2-(2-chlorophenyl)quinolin-4-yl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: isopropyl 5-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[2-(2-chlorophenyl)-4-quinolinyl]-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid isopropyl ester Formula: C26H20ClN3O3S MolecularWeight: 489.9733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4Cl)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4Cl)C(=O)OC(C)C

InChI

InChI=1S/C26H20ClN3O3S/c1-14(2)33-26(32)23-15(3)19(13-28)25(34-23)30-24(31)18-12-22(17-9-4-6-10-20(17)27)29-21-11-7-5-8-16(18)21/h4-12,14H,1-3H3,(H,30,31)