N-methyl-6-(4-methylpiperazin-1-yl)-5-nitro-N-(phenylmethyl)pyrimidin-4-amine

Systemtic Name: N-methyl-6-(4-methylpiperazin-1-yl)-5-nitro-N-(phenylmethyl)pyrimidin-4-amine Openeye Name: N-benzyl-N-methyl-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-methyl-6-(4-methyl-1-piperazinyl)-5-nitro-N-(phenylmethyl)-4-pyrimidinamine IUPAC Name: N-benzyl-N-methyl-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: benzyl-methyl-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H22N6O2 MolecularWeight: 342.39558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC=N2)N(C)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC=N2)N(C)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H22N6O2/c1-20-8-10-22(11-9-20)17-15(23(24)25)16(18-13-19-17)21(2)12-14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3