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

Systemtic Name: N4-methyl-N2-(2-methylpropyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2-isobutyl-N4-methyl-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N4-methyl-N2-(2-methylpropyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 4-N-methyl-2-N-(2-methylpropyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [6-amino-2-(isobutylamino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C9H16N6O2 MolecularWeight: 240.26234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=C(C(=N1)NC)[N+](=O)[O-])N

Isomeric SMILES

CC(C)CNC1=NC(=C(C(=N1)NC)[N+](=O)[O-])N

InChI

InChI=1S/C9H16N6O2/c1-5(2)4-12-9-13-7(10)6(15(16)17)8(11-3)14-9/h5H,4H2,1-3H3,(H4,10,11,12,13,14)