AC1OBO8Q structure

AC1OBO8Q

2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(4-propoxyphenyl)methylideneamino]acetamide

Also Known As: 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-propoxyphenyl)methylidene]acetohydrazide|(E)-2-((5-(4-chlorophenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N'-(4-propoxybenzylidene)acetohydrazide|2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(4-propoxyphenyl)methylideneamino]acetamide|2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio}-N'-[(E)-(4-propoxyphenyl)methylidene]acetohydrazide|N-[(1E)-2-(4-propoxyphenyl)-1-azavinyl]-2-[5-(4-chlorophenyl)-4-(4-methylpheny l)(1,2,4-triazol-3-ylthio)]acetamide

CAS: 315232-03-2
Molecular Formula C27H26ClN5O2S
Molecular Weight 519.1496 g/mol
LogP 5.92732
Topological Polar Surface Area 81.4 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 10
Exact Mass 519.1496
Monoisotopic Mass 519.1496
Heavy Atoms 36
Complexity 1320.0436

Chemical Identifiers

CAS Number 315232-03-2
SMILES CCCOC1=CC=C(C=C1)/C=N/NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)C)C4=CC=C(C=C4)Cl

Product Overview

AC1OBO8Q (CAS 315232-03-2), with molecular formula C27H26ClN5O2S and molecular weight 519.1496 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(4-propoxyphenyl)methylideneamino]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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