2-[4-[[5-(4-cyanophenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[[5-(4-cyanophenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[[5-(4-cyanophenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[[5-(4-cyanophenyl)-1H-pyrazol-4-yl]methyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[[5-(4-cyanophenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[[5-(4-cyanophenyl)-1H-pyrazol-4-yl]methyl]piperazino]isonicotinonitrile Formula: C21H19N7 MolecularWeight: 369.42246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(NN=C2)C3=CC=C(C=C3)C#N)C4=NC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCN1CC2=C(NN=C2)C3=CC=C(C=C3)C#N)C4=NC=CC(=C4)C#N

InChI

InChI=1S/C21H19N7/c22-12-16-1-3-18(4-2-16)21-19(14-25-26-21)15-27-7-9-28(10-8-27)20-11-17(13-23)5-6-24-20/h1-6,11,14H,7-10,15H2,(H,25,26)