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

Systemtic Name: propan-2-yl 4-cyano-3-methyl-5-[[3-methyl-2-(4-methylphenyl)quinolin-4-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-3-methyl-5-[[3-methyl-2-(p-tolyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[[3-methyl-2-(4-methylphenyl)-4-quinolinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-3-methyl-5-[[3-methyl-2-(4-methylphenyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[[3-methyl-2-(p-tolyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylic acid isopropyl ester Formula: C28H25N3O3S MolecularWeight: 483.5814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2C)C(=O)NC4=C(C(=C(S4)C(=O)OC(C)C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2C)C(=O)NC4=C(C(=C(S4)C(=O)OC(C)C)C)C#N

InChI

InChI=1S/C28H25N3O3S/c1-15(2)34-28(33)25-17(4)21(14-29)27(35-25)31-26(32)23-18(5)24(19-12-10-16(3)11-13-19)30-22-9-7-6-8-20(22)23/h6-13,15H,1-5H3,(H,31,32)