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

Systemtic Name: N2-methyl-N4-(4-methylphenyl)-5-nitro-N2-phenyl-pyrimidine-2,4,6-triamine Openeye Name: N2-methyl-5-nitro-N2-phenyl-N4-(p-tolyl)pyrimidine-2,4,6-triamine CAS Name: N2-methyl-N4-(4-methylphenyl)-5-nitro-N2-phenylpyrimidine-2,4,6-triamine IUPAC Name: 2-N-methyl-4-N-(4-methylphenyl)-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine Traditional Name: [4-amino-5-nitro-6-(p-toluidino)pyrimidin-2-yl]-methyl-phenyl-amine Formula: C18H18N6O2 MolecularWeight: 350.37452

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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)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)N(C)C3=CC=CC=C3

InChI

InChI=1S/C18H18N6O2/c1-12-8-10-13(11-9-12)20-17-15(24(25)26)16(19)21-18(22-17)23(2)14-6-4-3-5-7-14/h3-11H,1-2H3,(H3,19,20,21,22)