N4-methyl-5-nitro-N2-(phenylmethyl)pyrimidine-2,4,6-triamine

Systemtic Name: N4-methyl-5-nitro-N2-(phenylmethyl)pyrimidine-2,4,6-triamine Openeye Name: N2-benzyl-N4-methyl-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N4-methyl-5-nitro-N2-(phenylmethyl)pyrimidine-2,4,6-triamine IUPAC Name: 2-N-benzyl-4-N-methyl-5-nitropyrimidine-2,4,6-triamine Traditional Name: [6-amino-2-(benzylamino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C12H14N6O2 MolecularWeight: 274.27856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC(=C1[N+](=O)[O-])N)NCC2=CC=CC=C2

Isomeric SMILES

CNC1=NC(=NC(=C1[N+](=O)[O-])N)NCC2=CC=CC=C2

InChI

InChI=1S/C12H14N6O2/c1-14-11-9(18(19)20)10(13)16-12(17-11)15-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H4,13,14,15,16,17)