5-methylsulfanyl-2-octyl-1,2,4-triazol-3-amine

Systemtic Name: 5-methylsulfanyl-2-octyl-1,2,4-triazol-3-amine Openeye Name: 5-methylsulfanyl-2-octyl-1,2,4-triazol-3-amine CAS Name: 5-(methylthio)-2-octyl-1,2,4-triazol-3-amine IUPAC Name: 5-methylsulfanyl-2-octyl-1,2,4-triazol-3-amine Traditional Name: [5-(methylthio)-2-octyl-1,2,4-triazol-3-yl]amine Formula: C11H22N4S MolecularWeight: 242.38418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=NC(=N1)SC)N

Isomeric SMILES

CCCCCCCCN1C(=NC(=N1)SC)N

InChI

InChI=1S/C11H22N4S/c1-3-4-5-6-7-8-9-15-10(12)13-11(14-15)16-2/h3-9H2,1-2H3,(H2,12,13,14)