3-[3-(4-fluoranylphenoxy)propylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[3-(4-fluoranylphenoxy)propylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[3-(4-fluorophenoxy)propylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[3-(4-fluorophenoxy)propylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[3-(4-fluorophenoxy)propylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[3-(4-fluorophenoxy)propylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C11H13FN4OS MolecularWeight: 268.310523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCSC2=NNC(=N2)N)F

Isomeric SMILES

C1=CC(=CC=C1OCCCSC2=NNC(=N2)N)F

InChI

InChI=1S/C11H13FN4OS/c12-8-2-4-9(5-3-8)17-6-1-7-18-11-14-10(13)15-16-11/h2-5H,1,6-7H2,(H3,13,14,15,16)