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

Systemtic Name: ethyl 4-cyano-5-[[2-(4-methoxyphenyl)-3-methyl-quinolin-4-yl]carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[[2-(4-methoxyphenyl)-3-methyl-quinoline-4-carbonyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[[2-(4-methoxyphenyl)-3-methyl-4-quinolinyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[[2-(4-methoxyphenyl)-3-methylquinoline-4-carbonyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[2-(4-methoxyphenyl)-3-methyl-quinoline-4-carbonyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C27H23N3O4S MolecularWeight: 485.55422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC)C)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC)C)C#N)C

InChI

InChI=1S/C27H23N3O4S/c1-5-34-27(32)24-15(2)20(14-28)26(35-24)30-25(31)22-16(3)23(17-10-12-18(33-4)13-11-17)29-21-9-7-6-8-19(21)22/h6-13H,5H2,1-4H3,(H,30,31)