1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazole-4-carbonitrile

Systemtic Name: 1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazole-4-carbonitrile Openeye Name: 1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazole-4-carbonitrile CAS Name: 1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-4-pyrazolecarbonitrile IUPAC Name: 1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazole-4-carbonitrile Traditional Name: 1-[4-[4-(2-pyrimidyl)piperazino]butyl]pyrazole-4-carbonitrile Formula: C16H21N7 MolecularWeight: 311.38484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C=C(C=N2)C#N)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CCCCN2C=C(C=N2)C#N)C3=NC=CC=N3

InChI

InChI=1S/C16H21N7/c17-12-15-13-20-23(14-15)7-2-1-6-21-8-10-22(11-9-21)16-18-4-3-5-19-16/h3-5,13-14H,1-2,6-11H2