3-decylsulfanyl-5-octyl-1H-1,2,4-triazole

Systemtic Name: 3-decylsulfanyl-5-octyl-1H-1,2,4-triazole Openeye Name: 3-decylsulfanyl-5-octyl-1H-1,2,4-triazole CAS Name: 3-(decylthio)-5-octyl-1H-1,2,4-triazole IUPAC Name: 3-decylsulfanyl-5-octyl-1H-1,2,4-triazole Traditional Name: 3-(decylthio)-5-octyl-1H-1,2,4-triazole Formula: C20H39N3S MolecularWeight: 353.60876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=NNC(=N1)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCSC1=NNC(=N1)CCCCCCCC

InChI

InChI=1S/C20H39N3S/c1-3-5-7-9-11-12-14-16-18-24-20-21-19(22-23-20)17-15-13-10-8-6-4-2/h3-18H2,1-2H3,(H,21,22,23)