4-[4-[[4-(5-chloranylpyridin-2-yl)piperazin-1-yl]methyl]-1H-pyrazol-5-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[[4-(5-chloranylpyridin-2-yl)piperazin-1-yl]methyl]-1H-pyrazol-5-yl]benzenecarbonitrile Openeye Name: 4-[4-[[4-(5-chloro-2-pyridyl)piperazin-1-yl]methyl]-1H-pyrazol-5-yl]benzonitrile CAS Name: 4-[4-[[4-(5-chloro-2-pyridinyl)-1-piperazinyl]methyl]-1H-pyrazol-5-yl]benzonitrile IUPAC Name: 4-[4-[[4-(5-chloropyridin-2-yl)piperazin-1-yl]methyl]-1H-pyrazol-5-yl]benzonitrile Traditional Name: 4-[4-[[4-(5-chloro-2-pyridyl)piperazino]methyl]-1H-pyrazol-5-yl]benzonitrile Formula: C20H19ClN6 MolecularWeight: 378.85806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN6/c21-18-5-6-19(23-13-18)27-9-7-26(8-10-27)14-17-12-24-25-20(17)16-3-1-15(11-22)2-4-16/h1-6,12-13H,7-10,14H2,(H,24,25)