N4-(2-fluorophenyl)-2-(4-methylpiperidin-1-yl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(2-fluorophenyl)-2-(4-methylpiperidin-1-yl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2-fluorophenyl)-2-(4-methyl-1-piperidyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-fluorophenyl)-2-(4-methyl-1-piperidinyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2-fluorophenyl)-2-(4-methylpiperidin-1-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-amino-2-(4-methylpiperidino)-5-nitro-pyrimidin-4-yl]-(2-fluorophenyl)amine Formula: C16H19FN6O2 MolecularWeight: 346.359463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=C(C(=N2)NC3=CC=CC=C3F)[N+](=O)[O-])N

Isomeric SMILES

CC1CCN(CC1)C2=NC(=C(C(=N2)NC3=CC=CC=C3F)[N+](=O)[O-])N

InChI

InChI=1S/C16H19FN6O2/c1-10-6-8-22(9-7-10)16-20-14(18)13(23(24)25)15(21-16)19-12-5-3-2-4-11(12)17/h2-5,10H,6-9H2,1H3,(H3,18,19,20,21)