5-(8-butylsulfanyl-3-methyl-octan-3-yl)-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-(8-butylsulfanyl-3-methyl-octan-3-yl)-1H-1,2,4-triazol-3-amine Openeye Name: 5-(6-butylsulfanyl-1-ethyl-1-methyl-hexyl)-1H-1,2,4-triazol-3-amine CAS Name: 5-[8-(butylthio)-3-methyloctan-3-yl]-1H-1,2,4-triazol-3-amine IUPAC Name: 5-(8-butylsulfanyl-3-methyloctan-3-yl)-1H-1,2,4-triazol-3-amine Traditional Name: [5-[6-(butylthio)-1-ethyl-1-methyl-hexyl]-1H-1,2,4-triazol-3-yl]amine Formula: C15H30N4S MolecularWeight: 298.4905

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCCCC(C)(CC)C1=NC(=NN1)N

Isomeric SMILES

CCCCSCCCCCC(C)(CC)C1=NC(=NN1)N

InChI

InChI=1S/C15H30N4S/c1-4-6-11-20-12-9-7-8-10-15(3,5-2)13-17-14(16)19-18-13/h4-12H2,1-3H3,(H3,16,17,18,19)