6-diazanyl-N-[(4-methylphenyl)methyl]-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-diazanyl-N-[(4-methylphenyl)methyl]-5-nitro-pyrimidin-4-amine Openeye Name: 6-hydrazino-5-nitro-N-(p-tolylmethyl)pyrimidin-4-amine CAS Name: 6-hydrazinyl-N-[(4-methylphenyl)methyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-hydrazinyl-N-[(4-methylphenyl)methyl]-5-nitropyrimidin-4-amine Traditional Name: (6-hydrazino-5-nitro-pyrimidin-4-yl)-(4-methylbenzyl)amine Formula: C12H14N6O2 MolecularWeight: 274.27856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NN)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NN)[N+](=O)[O-]

InChI

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