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

Systemtic Name: ethyl 4-cyano-5-[[2-(2,4-dichlorophenyl)-3-methyl-quinolin-4-yl]carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[[2-(2,4-dichlorophenyl)-3-methyl-quinoline-4-carbonyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[[2-(2,4-dichlorophenyl)-3-methyl-4-quinolinyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[[2-(2,4-dichlorophenyl)-3-methylquinoline-4-carbonyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[2-(2,4-dichlorophenyl)-3-methyl-quinoline-4-carbonyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C26H19Cl2N3O3S MolecularWeight: 524.41836

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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=C(C=C(C=C4)Cl)Cl)C)C#N)C

Isomeric SMILES

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

InChI

InChI=1S/C26H19Cl2N3O3S/c1-4-34-26(33)23-13(2)18(12-29)25(35-23)31-24(32)21-14(3)22(16-10-9-15(27)11-19(16)28)30-20-8-6-5-7-17(20)21/h5-11H,4H2,1-3H3,(H,31,32)