N4-[(4-azanylcyclohexyl)methyl]-N2-[2-(4-fluorophenyl)ethyl]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N4-[(4-azanylcyclohexyl)methyl]-N2-[2-(4-fluorophenyl)ethyl]-5-nitro-pyrimidine-2,4-diamine Openeye Name: N4-[(4-aminocyclohexyl)methyl]-N2-[2-(4-fluorophenyl)ethyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: N4-[(4-aminocyclohexyl)methyl]-N2-[2-(4-fluorophenyl)ethyl]-5-nitropyrimidine-2,4-diamine IUPAC Name: 4-N-[(4-aminocyclohexyl)methyl]-2-N-[2-(4-fluorophenyl)ethyl]-5-nitropyrimidine-2,4-diamine Traditional Name: (4-aminocyclohexyl)methyl-[2-[2-(4-fluorophenyl)ethylamino]-5-nitro-pyrimidin-4-yl]amine Formula: C19H25FN6O2 MolecularWeight: 388.439203

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC2=NC(=NC=C2[N+](=O)[O-])NCCC3=CC=C(C=C3)F)N

Isomeric SMILES

C1CC(CCC1CNC2=NC(=NC=C2[N+](=O)[O-])NCCC3=CC=C(C=C3)F)N

InChI

InChI=1S/C19H25FN6O2/c20-15-5-1-13(2-6-15)9-10-22-19-24-12-17(26(27)28)18(25-19)23-11-14-3-7-16(21)8-4-14/h1-2,5-6,12,14,16H,3-4,7-11,21H2,(H2,22,23,24,25)