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

Systemtic Name: N6-(4-bromophenyl)-N4-[4-chloranyl-3-(trifluoromethyl)phenyl]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(4-bromophenyl)-N4-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(4-bromophenyl)-N4-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(4-bromophenyl)-4-N-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(4-bromoanilino)-5-nitro-pyrimidin-4-yl]-[4-chloro-3-(trifluoromethyl)phenyl]amine Formula: C17H10BrClF3N5O2 MolecularWeight: 488.64581

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10BrClF3N5O2/c18-9-1-3-10(4-2-9)25-15-14(27(28)29)16(24-8-23-15)26-11-5-6-13(19)12(7-11)17(20,21)22/h1-8H,(H2,23,24,25,26)