(4E)-5-methyl-4-[(4-methylphenyl)methylidene]-2-(8-oxidanylquinolin-5-yl)sulfonyl-pyrazol-3-one

Systemtic Name: (4E)-5-methyl-4-[(4-methylphenyl)methylidene]-2-(8-oxidanylquinolin-5-yl)sulfonyl-pyrazol-3-one Openeye Name: (4E)-2-[(8-hydroxy-5-quinolyl)sulfonyl]-5-methyl-4-(p-tolylmethylene)pyrazol-3-one CAS Name: (4E)-2-[(8-hydroxy-5-quinolinyl)sulfonyl]-5-methyl-4-[(4-methylphenyl)methylidene]-3-pyrazolone IUPAC Name: (4E)-2-(8-hydroxyquinolin-5-yl)sulfonyl-5-methyl-4-[(4-methylphenyl)methylidene]pyrazol-3-one Traditional Name: (4E)-2-[(8-hydroxy-5-quinolyl)sulfonyl]-5-methyl-4-(4-methylbenzylidene)-2-pyrazolin-3-one Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=NN(C2=O)S(=O)(=O)C3=C4C=CC=NC4=C(C=C3)O)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/2\C(=NN(C2=O)S(=O)(=O)C3=C4C=CC=NC4=C(C=C3)O)C

InChI

InChI=1S/C21H17N3O4S/c1-13-5-7-15(8-6-13)12-17-14(2)23-24(21(17)26)29(27,28)19-10-9-18(25)20-16(19)4-3-11-22-20/h3-12,25H,1-2H3/b17-12+