N2-[4-chloranyl-3-(trifluoromethyl)phenyl]-N4-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-[4-chloranyl-3-(trifluoromethyl)phenyl]-N4-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-[4-chloro-3-(trifluoromethyl)phenyl]-N4-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-[4-chloro-3-(trifluoromethyl)phenyl]-N4-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-[4-chloro-3-(trifluoromethyl)phenyl]-4-N-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: [2-[4-chloro-3-(trifluoromethyl)anilino]-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C12H9ClF3N5O2 MolecularWeight: 347.68037

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C12H9ClF3N5O2/c1-17-10-9(21(22)23)5-18-11(20-10)19-6-2-3-8(13)7(4-6)12(14,15)16/h2-5H,1H3,(H2,17,18,19,20)