2-chloranyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)benzenecarbonitrile

Systemtic Name: 2-chloranyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)benzenecarbonitrile Openeye Name: 2-chloro-6-(4-pyrimidin-2-ylpiperazin-1-yl)benzonitrile CAS Name: 2-chloro-6-[4-(2-pyrimidinyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-chloro-6-(4-pyrimidin-2-ylpiperazin-1-yl)benzonitrile Traditional Name: 2-chloro-6-[4-(2-pyrimidyl)piperazino]benzonitrile Formula: C15H14ClN5 MolecularWeight: 299.75816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=CC=C2)Cl)C#N)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)Cl)C#N)C3=NC=CC=N3

InChI

InChI=1S/C15H14ClN5/c16-13-3-1-4-14(12(13)11-17)20-7-9-21(10-8-20)15-18-5-2-6-19-15/h1-6H,7-10H2