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

Systemtic Name: N4-[2-chloranyl-5-(trifluoromethyl)phenyl]-N6-(4-iodophenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[2-chloro-5-(trifluoromethyl)phenyl]-N6-(4-iodophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[2-chloro-5-(trifluoromethyl)phenyl]-N6-(4-iodophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-N-(4-iodophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-[2-chloro-5-(trifluoromethyl)anilino]-5-nitro-pyrimidin-4-yl]-(4-iodophenyl)amine Formula: C17H10ClF3IN5O2 MolecularWeight: 535.64628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C(=NC=N2)NC3=C(C=CC(=C3)C(F)(F)F)Cl)[N+](=O)[O-])I

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C(=NC=N2)NC3=C(C=CC(=C3)C(F)(F)F)Cl)[N+](=O)[O-])I

InChI

InChI=1S/C17H10ClF3IN5O2/c18-12-6-1-9(17(19,20)21)7-13(12)26-16-14(27(28)29)15(23-8-24-16)25-11-4-2-10(22)3-5-11/h1-8H,(H2,23,24,25,26)