N4-cyclohexyl-N2-(3-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N4-cyclohexyl-N2-(3-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N4-cyclohexyl-N2-(3-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N4-cyclohexyl-N2-(3-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 4-N-cyclohexyl-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-(cyclohexylamino)-5-nitro-pyrimidin-2-yl]-(3-fluorophenyl)amine Formula: C16H19FN6O2 MolecularWeight: 346.359463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC(=CC=C3)F

Isomeric SMILES

C1CCC(CC1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC(=CC=C3)F

InChI

InChI=1S/C16H19FN6O2/c17-10-5-4-8-12(9-10)20-16-21-14(18)13(23(24)25)15(22-16)19-11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7H2,(H4,18,19,20,21,22)