AC1OAI5T structure

AC1OAI5T

3-cyclohexyl-4-[(E)-(4-methylsulfanylphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Also Known As: (E)-5-cyclohexyl-4-((4-(methylthio)benzylidene)amino)-4H-1,2,4-triazole-3-thiol|3-cyclohexyl-4-[(E)-(4-methylsulfanylphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione|5-cyclohexyl-4-({(E)-[4-(methylthio)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol|5-cyclohexyl-4-[(4-methylsulfanylphenyl)methylideneamino]-2H-1,2,4-triazole-3-thione|5-cyclohexyl-4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione

CAS: 613247-16-8
Molecular Formula C16H20N4S2
Molecular Weight 332.11295 g/mol
LogP 4.59249
Topological Polar Surface Area 45.97 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 332.11295
Monoisotopic Mass 332.11295
Heavy Atoms 22
Complexity 693.681

Chemical Identifiers

CAS Number 613247-16-8
SMILES CSC1=CC=C(C=C1)/C=N/N2C(=NNC2=S)C3CCCCC3

Product Overview

AC1OAI5T (CAS 613247-16-8), with molecular formula C16H20N4S2 and molecular weight 332.11295 g/mol. IUPAC: 3-cyclohexyl-4-[(E)-(4-methylsulfanylphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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