AC1O2YZL structure

AC1O2YZL

(5Z)-5-[[3-(4-butoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-cyclopentyl-2-sulfanylidene-1,3-thiazolidin-4-one

Also Known As: (5Z)-5-{[3-(4-BUTOXY-3-METHYLPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]METHYLENE}-3-CYCLOPENTYL-2-THIOXO-1,3-THIAZOLIDIN-4-ONE|5-((3-(4-Butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-3-cyclopentyl-2-thioxothiazolidin-4-one|(5Z)-5-((3-(4-BUTOXY-3-METHYLPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL)METHYLENE)-3-CYCLOPENTYL-2-THIOXO-1,3-THIAZOLIDIN-4-ONE|(5Z)-5-[[3-(4-butoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-cyclopentyl-2-sulfanylidene-1,3-thiazolidin-4-one|(5Z)-5-{[3-(4-butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one|644-436-5

CAS: 623940-53-4
Molecular Formula C29H31N3O2S2
Molecular Weight 517.1858 g/mol
LogP 7.17042
Topological Polar Surface Area 47.36 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 517.1858
Monoisotopic Mass 517.1858
Heavy Atoms 36
Complexity 1293.103

Chemical Identifiers

CAS Number 623940-53-4
SMILES CCCCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C\3/C(=O)N(C(=S)S3)C4CCCC4)C5=CC=CC=C5)C

Product Overview

AC1O2YZL (CAS 623940-53-4), with molecular formula C29H31N3O2S2 and molecular weight 517.1858 g/mol. IUPAC: (5Z)-5-[[3-(4-butoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-cyclopentyl-2-sulfanylidene-1,3-thiazolidin-4-one.

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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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