5-octyl-3-prop-2-enylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-octyl-3-prop-2-enylsulfanyl-1H-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-octyl-1H-1,2,4-triazole CAS Name: 5-octyl-3-(prop-2-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-octyl-3-prop-2-enylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(allylthio)-5-octyl-1H-1,2,4-triazole Formula: C13H23N3S MolecularWeight: 253.40682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NC(=NN1)SCC=C

Isomeric SMILES

CCCCCCCCC1=NC(=NN1)SCC=C

InChI

InChI=1S/C13H23N3S/c1-3-5-6-7-8-9-10-12-14-13(16-15-12)17-11-4-2/h4H,2-3,5-11H2,1H3,(H,14,15,16)