2-[2-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]-4-(4-methylphenyl)thiophene-3-carboxamide

Systemtic Name: 2-[2-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]-4-(4-methylphenyl)thiophene-3-carboxamide Openeye Name: 2-[2-(4,8-dimethyl-2-oxo-1-quinolyl)butanoylamino]-4-(p-tolyl)thiophene-3-carboxamide CAS Name: 2-[[2-(4,8-dimethyl-2-oxo-1-quinolinyl)-1-oxobutyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxamide IUPAC Name: 2-[2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanoylamino]-4-(4-methylphenyl)thiophene-3-carboxamide Traditional Name: 2-[2-(2-keto-4,8-dimethyl-1-quinolyl)butanoylamino]-4-(p-tolyl)thiophene-3-carboxamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)N)N3C(=O)C=C(C4=C3C(=CC=C4)C)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)N)N3C(=O)C=C(C4=C3C(=CC=C4)C)C

InChI

InChI=1S/C27H27N3O3S/c1-5-21(30-22(31)13-17(4)19-8-6-7-16(3)24(19)30)26(33)29-27-23(25(28)32)20(14-34-27)18-11-9-15(2)10-12-18/h6-14,21H,5H2,1-4H3,(H2,28,32)(H,29,33)