3-octylsulfanyl-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-octylsulfanyl-1H-1,2,4-triazol-5-amine Openeye Name: 3-octylsulfanyl-1H-1,2,4-triazol-5-amine CAS Name: 3-(octylthio)-1H-1,2,4-triazol-5-amine IUPAC Name: 3-octylsulfanyl-1H-1,2,4-triazol-5-amine Traditional Name: [3-(octylthio)-1H-1,2,4-triazol-5-yl]amine Formula: C10H20N4S MolecularWeight: 228.3576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NNC(=N1)N

Isomeric SMILES

CCCCCCCCSC1=NNC(=N1)N

InChI

InChI=1S/C10H20N4S/c1-2-3-4-5-6-7-8-15-10-12-9(11)13-14-10/h2-8H2,1H3,(H3,11,12,13,14)