5-[bis(fluoranyl)-pyrimidin-2-ylsulfanyl-methyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[bis(fluoranyl)-pyrimidin-2-ylsulfanyl-methyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[difluoro(pyrimidin-2-ylsulfanyl)methyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[difluoro-(2-pyrimidinylthio)methyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[difluoro(pyrimidin-2-ylsulfanyl)methyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[difluoro-(2-pyrimidylthio)methyl]-3-phenyl-1,2,4-oxadiazole Formula: C13H8F2N4OS MolecularWeight: 306.290626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=N2)C(F)(F)SC3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=N2)C(F)(F)SC3=NC=CC=N3

InChI

InChI=1S/C13H8F2N4OS/c14-13(15,21-12-16-7-4-8-17-12)11-18-10(19-20-11)9-5-2-1-3-6-9/h1-8H