5-bromanyl-2-[(4-fluorophenyl)methylsulfanyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-2-[(4-fluorophenyl)methylsulfanyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide Openeye Name: 5-bromo-2-[(4-fluorophenyl)methylsulfanyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide CAS Name: 5-bromo-2-[(4-fluorophenyl)methylthio]-N-[2-(trifluoromethyl)phenyl]-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-2-[(4-fluorophenyl)methylsulfanyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide Traditional Name: 5-bromo-2-[(4-fluorobenzyl)thio]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide Formula: C19H12BrF4N3OS MolecularWeight: 486.280693

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)C2=NC(=NC=C2Br)SCC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)C2=NC(=NC=C2Br)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H12BrF4N3OS/c20-14-9-25-18(29-10-11-5-7-12(21)8-6-11)27-16(14)17(28)26-15-4-2-1-3-13(15)19(22,23)24/h1-9H,10H2,(H,26,28)