N6-methyl-N4-[(4-methylphenyl)methyl]-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-methyl-N4-[(4-methylphenyl)methyl]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-methyl-5-nitro-N4-(p-tolylmethyl)pyrimidine-4,6-diamine CAS Name: N6-methyl-N4-[(4-methylphenyl)methyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-methyl-4-N-[(4-methylphenyl)methyl]-5-nitropyrimidine-4,6-diamine Traditional Name: methyl-[6-[(4-methylbenzyl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C13H15N5O2 MolecularWeight: 273.2905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])NC

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])NC

InChI

InChI=1S/C13H15N5O2/c1-9-3-5-10(6-4-9)7-15-13-11(18(19)20)12(14-2)16-8-17-13/h3-6,8H,7H2,1-2H3,(H2,14,15,16,17)