4-[5-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]morpholine

Systemtic Name: 4-[5-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[5-[(2-bromo-4-fluoro-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[5-[(2-bromo-4-fluorophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[5-[(2-bromo-4-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[5-[(2-bromo-4-fluoro-benzyl)thio]-4-methyl-1,2,4-triazol-3-yl]morpholine Formula: C14H16BrFN4OS MolecularWeight: 387.270443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=C(C=C2)F)Br)N3CCOCC3

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=C(C=C2)F)Br)N3CCOCC3

InChI

InChI=1S/C14H16BrFN4OS/c1-19-13(20-4-6-21-7-5-20)17-18-14(19)22-9-10-2-3-11(16)8-12(10)15/h2-3,8H,4-7,9H2,1H3