2-[[3-[2-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)quinolin-4-yl]pyrazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[3-[2-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)quinolin-4-yl]pyrazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[3-[2-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-4-quinolyl]pyrazol-1-yl]methyl]benzonitrile CAS Name: 2-[[3-[2-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-4-quinolinyl]-1-pyrazolyl]methyl]benzonitrile IUPAC Name: 2-[[3-[2-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)quinolin-4-yl]pyrazol-1-yl]methyl]benzonitrile Traditional Name: 2-[[3-[2-(3-keto-5-methyl-3-pyrazolin-4-yl)-4-quinolyl]pyrazol-1-yl]methyl]benzonitrile Formula: C24H18N6O MolecularWeight: 406.43932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C2=NC3=CC=CC=C3C(=C2)C4=NN(C=C4)CC5=CC=CC=C5C#N

Isomeric SMILES

CC1=C(C(=O)NN1)C2=NC3=CC=CC=C3C(=C2)C4=NN(C=C4)CC5=CC=CC=C5C#N

InChI

InChI=1S/C24H18N6O/c1-15-23(24(31)28-27-15)22-12-19(18-8-4-5-9-20(18)26-22)21-10-11-30(29-21)14-17-7-3-2-6-16(17)13-25/h2-12H,14H2,1H3,(H2,27,28,31)