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

Systemtic Name: methyl 5-[[2-(4-chlorophenyl)-3-methyl-quinolin-4-yl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[[2-(4-chlorophenyl)-3-methyl-quinoline-4-carbonyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[2-(4-chlorophenyl)-3-methyl-4-quinolinyl]-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(4-chlorophenyl)-3-methylquinoline-4-carbonyl]amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-(4-chlorophenyl)-3-methyl-quinoline-4-carbonyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C25H18ClN3O3S MolecularWeight: 475.94672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H18ClN3O3S/c1-13-18(12-27)24(33-22(13)25(31)32-3)29-23(30)20-14(2)21(15-8-10-16(26)11-9-15)28-19-7-5-4-6-17(19)20/h4-11H,1-3H3,(H,29,30)