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

Systemtic Name: N2,N4-bis(4-methylphenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: 5-nitro-N2,N4-bis(p-tolyl)pyrimidine-2,4,6-triamine CAS Name: N2,N4-bis(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N,4-N-bis(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-5-nitro-6-(p-toluidino)pyrimidin-2-yl]-(p-tolyl)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)NC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC=C(C=C3)C

InChI

InChI=1S/C18H18N6O2/c1-11-3-7-13(8-4-11)20-17-15(24(25)26)16(19)22-18(23-17)21-14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H4,19,20,21,22,23)