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

Systemtic Name: N4-(2-fluorophenyl)-N2-[(4-methylphenyl)methyl]-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N4-(2-fluorophenyl)-5-nitro-N2-(p-tolylmethyl)pyrimidine-2,4,6-triamine CAS Name: N4-(2-fluorophenyl)-N2-[(4-methylphenyl)methyl]-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 4-N-(2-fluorophenyl)-2-N-[(4-methylphenyl)methyl]-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-(2-fluoroanilino)-5-nitro-pyrimidin-2-yl]-(4-methylbenzyl)amine Formula: C18H17FN6O2 MolecularWeight: 368.364983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NC3=CC=CC=C3F)[N+](=O)[O-])N

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NC3=CC=CC=C3F)[N+](=O)[O-])N

InChI

InChI=1S/C18H17FN6O2/c1-11-6-8-12(9-7-11)10-21-18-23-16(20)15(25(26)27)17(24-18)22-14-5-3-2-4-13(14)19/h2-9H,10H2,1H3,(H4,20,21,22,23,24)