5-ethyl-3-octylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-ethyl-3-octylsulfanyl-1H-1,2,4-triazole Openeye Name: 5-ethyl-3-octylsulfanyl-1H-1,2,4-triazole CAS Name: 5-ethyl-3-(octylthio)-1H-1,2,4-triazole IUPAC Name: 5-ethyl-3-octylsulfanyl-1H-1,2,4-triazole Traditional Name: 5-ethyl-3-(octylthio)-1H-1,2,4-triazole Formula: C12H23N3S MolecularWeight: 241.39612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NNC(=N1)CC

Isomeric SMILES

CCCCCCCCSC1=NNC(=N1)CC

InChI

InChI=1S/C12H23N3S/c1-3-5-6-7-8-9-10-16-12-13-11(4-2)14-15-12/h3-10H2,1-2H3,(H,13,14,15)