5-dec-9-enyl-3-octylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-dec-9-enyl-3-octylsulfanyl-1H-1,2,4-triazole Openeye Name: 5-dec-9-enyl-3-octylsulfanyl-1H-1,2,4-triazole CAS Name: 5-dec-9-enyl-3-(octylthio)-1H-1,2,4-triazole IUPAC Name: 5-dec-9-enyl-3-octylsulfanyl-1H-1,2,4-triazole Traditional Name: 5-dec-9-enyl-3-(octylthio)-1H-1,2,4-triazole Formula: C20H37N3S MolecularWeight: 351.59288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NNC(=N1)CCCCCCCCC=C

Isomeric SMILES

CCCCCCCCSC1=NNC(=N1)CCCCCCCCC=C

InChI

InChI=1S/C20H37N3S/c1-3-5-7-9-11-12-13-15-17-19-21-20(23-22-19)24-18-16-14-10-8-6-4-2/h3H,1,4-18H2,2H3,(H,21,22,23)