N-[5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: N-[5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-[5-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide CAS Name: N-[5-[(4-bromo-2-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-[5-[(4-bromo-2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: N-[5-[(4-bromo-2-fluoro-benzyl)thio]-1,3,4-thiadiazol-2-yl]butyramide Formula: C13H13BrFN3OS2 MolecularWeight: 390.294223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NN=C(S1)SCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CCCC(=O)NC1=NN=C(S1)SCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H13BrFN3OS2/c1-2-3-11(19)16-12-17-18-13(21-12)20-7-8-4-5-9(14)6-10(8)15/h4-6H,2-3,7H2,1H3,(H,16,17,19)