N4-(4-methoxyphenyl)-N2-(3-methylphenyl)-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N4-(4-methoxyphenyl)-N2-(3-methylphenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N4-(4-methoxyphenyl)-N2-(m-tolyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N4-(4-methoxyphenyl)-N2-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 4-N-(4-methoxyphenyl)-2-N-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [6-amino-2-(m-toluidino)-5-nitro-pyrimidin-4-yl]-(4-methoxyphenyl)amine Formula: C18H18N6O3 MolecularWeight: 366.37392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=C(C(=N2)NC3=CC=C(C=C3)OC)[N+](=O)[O-])N

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=C(C(=N2)NC3=CC=C(C=C3)OC)[N+](=O)[O-])N

InChI

InChI=1S/C18H18N6O3/c1-11-4-3-5-13(10-11)21-18-22-16(19)15(24(25)26)17(23-18)20-12-6-8-14(27-2)9-7-12/h3-10H,1-2H3,(H4,19,20,21,22,23)