N4-(3-imidazol-1-ylpropyl)-N6-methyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(3-imidazol-1-ylpropyl)-N6-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(3-imidazol-1-ylpropyl)-N6-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[3-(1-imidazolyl)propyl]-N6-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(3-imidazol-1-ylpropyl)-6-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: 3-imidazol-1-ylpropyl-[6-(methylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C11H15N7O2 MolecularWeight: 277.2825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=NC=N1)NCCCN2C=CN=C2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C(=NC=N1)NCCCN2C=CN=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H15N7O2/c1-12-10-9(18(19)20)11(16-7-15-10)14-3-2-5-17-6-4-13-8-17/h4,6-8H,2-3,5H2,1H3,(H2,12,14,15,16)