2-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-6-methyl-quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-6-methyl-quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-6-methyl-quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-6-methyl-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-6-methylquinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-6-methyl-cinchoninamide Formula: C29H24N4O4 MolecularWeight: 492.52526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H24N4O4/c1-17-9-11-23-21(13-17)22(15-24(30-23)19-10-12-25-26(14-19)37-16-36-25)28(34)31-27-18(2)32(3)33(29(27)35)20-7-5-4-6-8-20/h4-15H,16H2,1-3H3,(H,31,34)