N2,N2-dimethyl-N4-(4-methylphenyl)-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N2,N2-dimethyl-N4-(4-methylphenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2,N2-dimethyl-5-nitro-N4-(p-tolyl)pyrimidine-2,4,6-triamine CAS Name: N2,N2-dimethyl-N4-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N,2-N-dimethyl-4-N-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-5-nitro-6-(p-toluidino)pyrimidin-2-yl]-dimethyl-amine Formula: C13H16N6O2 MolecularWeight: 288.30514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)N(C)C

InChI

InChI=1S/C13H16N6O2/c1-8-4-6-9(7-5-8)15-12-10(19(20)21)11(14)16-13(17-12)18(2)3/h4-7H,1-3H3,(H3,14,15,16,17)