5-fluoranyl-N2,N4-bis(4-fluoranyl-3-nitro-phenyl)pyrimidine-2,4-diamine

Systemtic Name: 5-fluoranyl-N2,N4-bis(4-fluoranyl-3-nitro-phenyl)pyrimidine-2,4-diamine Openeye Name: 5-fluoro-N2,N4-bis(4-fluoro-3-nitro-phenyl)pyrimidine-2,4-diamine CAS Name: 5-fluoro-N2,N4-bis(4-fluoro-3-nitrophenyl)pyrimidine-2,4-diamine IUPAC Name: 5-fluoro-2-N,4-N-bis(4-fluoro-3-nitrophenyl)pyrimidine-2,4-diamine Traditional Name: [5-fluoro-2-(4-fluoro-3-nitro-anilino)pyrimidin-4-yl]-(4-fluoro-3-nitro-phenyl)amine Formula: C16H9F3N6O4 MolecularWeight: 406.27567

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC(=NC=C2F)NC3=CC(=C(C=C3)F)[N+](=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC(=NC=C2F)NC3=CC(=C(C=C3)F)[N+](=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C16H9F3N6O4/c17-10-3-1-8(5-13(10)24(26)27)21-15-12(19)7-20-16(23-15)22-9-2-4-11(18)14(6-9)25(28)29/h1-7H,(H2,20,21,22,23)