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

Systemtic Name: N4-(4-methylphenyl)-N2-[(4-methylphenyl)methyl]-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: 5-nitro-N4-(p-tolyl)-N2-(p-tolylmethyl)pyrimidine-2,4,6-triamine CAS Name: N4-(4-methylphenyl)-N2-[(4-methylphenyl)methyl]-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 4-N-(4-methylphenyl)-2-N-[(4-methylphenyl)methyl]-5-nitropyrimidine-2,4,6-triamine Traditional Name: [6-amino-2-[(4-methylbenzyl)amino]-5-nitro-pyrimidin-4-yl]-(p-tolyl)amine Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NC3=CC=C(C=C3)C)[N+](=O)[O-])N

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NC3=CC=C(C=C3)C)[N+](=O)[O-])N

InChI

InChI=1S/C19H20N6O2/c1-12-3-7-14(8-4-12)11-21-19-23-17(20)16(25(26)27)18(24-19)22-15-9-5-13(2)6-10-15/h3-10H,11H2,1-2H3,(H4,20,21,22,23,24)