N4-[4-chloranyl-3-(trifluoromethyl)phenyl]-5-nitro-N6-(4-phenoxyphenyl)pyrimidine-4,6-diamine

Systemtic Name: N4-[4-chloranyl-3-(trifluoromethyl)phenyl]-5-nitro-N6-(4-phenoxyphenyl)pyrimidine-4,6-diamine Openeye Name: N4-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitro-N6-(4-phenoxyphenyl)pyrimidine-4,6-diamine CAS Name: N4-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitro-N6-(4-phenoxyphenyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitro-6-N-(4-phenoxyphenyl)pyrimidine-4,6-diamine Traditional Name: [6-[4-chloro-3-(trifluoromethyl)anilino]-5-nitro-pyrimidin-4-yl]-(4-phenoxyphenyl)amine Formula: C23H15ClF3N5O3 MolecularWeight: 501.84511

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=C(C(=NC=N3)NC4=CC(=C(C=C4)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=C(C(=NC=N3)NC4=CC(=C(C=C4)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H15ClF3N5O3/c24-19-11-8-15(12-18(19)23(25,26)27)31-22-20(32(33)34)21(28-13-29-22)30-14-6-9-17(10-7-14)35-16-4-2-1-3-5-16/h1-13H,(H2,28,29,30,31)