2-(4-methylpiperazin-1-yl)-4-oxidanylidene-6-pyridin-3-yl-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-(4-methylpiperazin-1-yl)-4-oxidanylidene-6-pyridin-3-yl-1H-pyrimidine-5-carbonitrile Openeye Name: 2-(4-methylpiperazin-1-yl)-4-oxo-6-(3-pyridyl)-1H-pyrimidine-5-carbonitrile CAS Name: 2-(4-methyl-1-piperazinyl)-4-oxo-6-(3-pyridinyl)-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(4-methylpiperazin-1-yl)-4-oxo-6-pyridin-3-yl-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-2-(4-methylpiperazino)-6-(3-pyridyl)-1H-pyrimidine-5-carbonitrile Formula: C15H16N6O MolecularWeight: 296.32714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=O)C(=C(N2)C3=CN=CC=C3)C#N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=O)C(=C(N2)C3=CN=CC=C3)C#N

InChI

InChI=1S/C15H16N6O/c1-20-5-7-21(8-6-20)15-18-13(11-3-2-4-17-10-11)12(9-16)14(22)19-15/h2-4,10H,5-8H2,1H3,(H,18,19,22)