4-[4-bromanyl-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-N-phenyl-pyrimidin-2-amine

Systemtic Name: 4-[4-bromanyl-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-N-phenyl-pyrimidin-2-amine Openeye Name: 4-[4-bromo-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-N-phenyl-pyrimidin-2-amine CAS Name: 4-[4-bromo-5-[3-(trifluoromethyl)phenyl]-1-pyrazolyl]-N-phenyl-2-pyrimidinamine IUPAC Name: 4-[4-bromo-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-N-phenylpyrimidin-2-amine Traditional Name: [4-[4-bromo-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]pyrimidin-2-yl]-phenyl-amine Formula: C20H13BrF3N5 MolecularWeight: 460.24993

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC=CC(=N2)N3C(=C(C=N3)Br)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC=CC(=N2)N3C(=C(C=N3)Br)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C20H13BrF3N5/c21-16-12-26-29(18(16)13-5-4-6-14(11-13)20(22,23)24)17-9-10-25-19(28-17)27-15-7-2-1-3-8-15/h1-12H,(H,25,27,28)