2-azanyl-3-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 2-azanyl-3-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 2-amino-3-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzonitrile CAS Name: 2-amino-3-[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]benzonitrile IUPAC Name: 2-amino-3-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzonitrile Traditional Name: 2-amino-3-[6-(4-methylpiperazino)pyrimidin-4-yl]benzonitrile Formula: C16H18N6 MolecularWeight: 294.35432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=NC(=C2)C3=CC=CC(=C3N)C#N

Isomeric SMILES

CN1CCN(CC1)C2=NC=NC(=C2)C3=CC=CC(=C3N)C#N

InChI

InChI=1S/C16H18N6/c1-21-5-7-22(8-6-21)15-9-14(19-11-20-15)13-4-2-3-12(10-17)16(13)18/h2-4,9,11H,5-8,18H2,1H3