N-(2-methylphenyl)-5-nitro-6-piperidin-1-yl-pyrimidin-4-amine

Systemtic Name: N-(2-methylphenyl)-5-nitro-6-piperidin-1-yl-pyrimidin-4-amine Openeye Name: 5-nitro-N-(o-tolyl)-6-(1-piperidyl)pyrimidin-4-amine CAS Name: N-(2-methylphenyl)-5-nitro-6-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: N-(2-methylphenyl)-5-nitro-6-piperidin-1-ylpyrimidin-4-amine Traditional Name: (5-nitro-6-piperidino-pyrimidin-4-yl)-(o-tolyl)amine Formula: C16H19N5O2 MolecularWeight: 313.35436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C16H19N5O2/c1-12-7-3-4-8-13(12)19-15-14(21(22)23)16(18-11-17-15)20-9-5-2-6-10-20/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,17,18,19)