N6-[2-chloranyl-5-(trifluoromethyl)phenyl]-N4-methyl-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-[2-chloranyl-5-(trifluoromethyl)phenyl]-N4-methyl-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-benzyl-N6-[2-chloro-5-(trifluoromethyl)phenyl]-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[2-chloro-5-(trifluoromethyl)phenyl]-N4-methyl-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-6-N-[2-chloro-5-(trifluoromethyl)phenyl]-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: benzyl-[6-[2-chloro-5-(trifluoromethyl)anilino]-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C19H15ClF3N5O2 MolecularWeight: 437.80291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C19H15ClF3N5O2/c1-27(10-12-5-3-2-4-6-12)18-16(28(29)30)17(24-11-25-18)26-15-9-13(19(21,22)23)7-8-14(15)20/h2-9,11H,10H2,1H3,(H,24,25,26)