4-[5-methyl-2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]-3-oxidanylidene-pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[5-methyl-2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]-3-oxidanylidene-pyrazol-1-yl]benzenecarbonitrile Openeye Name: 4-[5-methyl-2-[3-[4-(4-methyl-2-pyridyl)piperazin-1-yl]propyl]-3-oxo-pyrazol-1-yl]benzonitrile CAS Name: 4-[5-methyl-2-[3-[4-(4-methyl-2-pyridinyl)-1-piperazinyl]propyl]-3-oxo-1-pyrazolyl]benzonitrile IUPAC Name: 4-[5-methyl-2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]-3-oxopyrazol-1-yl]benzonitrile Traditional Name: 4-[3-keto-5-methyl-2-[3-[4-(4-methyl-2-pyridyl)piperazino]propyl]-3-pyrazolin-1-yl]benzonitrile Formula: C24H28N6O MolecularWeight: 416.51872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2CCN(CC2)CCCN3C(=O)C=C(N3C4=CC=C(C=C4)C#N)C

Isomeric SMILES

CC1=CC(=NC=C1)N2CCN(CC2)CCCN3C(=O)C=C(N3C4=CC=C(C=C4)C#N)C

InChI

InChI=1S/C24H28N6O/c1-19-8-9-26-23(16-19)28-14-12-27(13-15-28)10-3-11-29-24(31)17-20(2)30(29)22-6-4-21(18-25)5-7-22/h4-9,16-17H,3,10-15H2,1-2H3