AC1OAQ8B structure

AC1OAQ8B

2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]acetamide

Also Known As: 2-{[4,5-bis(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]acetohydrazide|(E)-N'-((Z)-2-chloro-3-phenylallylidene)-2-((4,5-di-p-tolyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide|2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]acetamide|2-{[4,5-BIS(4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}-N'-[(E,2Z)-2-CHLORO-3-PHENYL-2-PROPENYLIDENE]ACETOHYDRAZIDE|N-((3Z,1E)-3-chloro-4-phenyl-1-azabuta-1,3-dienyl)-2-[4,5-bis(4-methylphenyl)( 1,2,4-triazol-3-ylthio)]acetamide

CAS: 488792-88-7
Molecular Formula C27H24ClN5OS
Molecular Weight 501.139 g/mol
LogP 6.02514
Topological Polar Surface Area 72.17 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 501.139
Monoisotopic Mass 501.139
Heavy Atoms 35
Complexity 1346.8542

Chemical Identifiers

CAS Number 488792-88-7
SMILES CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)C)SCC(=O)N/N=C/C(=C/C4=CC=CC=C4)/Cl

Product Overview

AC1OAQ8B (CAS 488792-88-7), with molecular formula C27H24ClN5OS and molecular weight 501.139 g/mol. IUPAC: 2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]acetamide.

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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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