AC1Q3IMJ structure

AC1Q3IMJ

1-(4-chlorophenyl)-2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanone

Also Known As: 1-(4-chlorophenyl)-2-{[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone|1-(4-chlorophenyl)-2-(5-(2-furyl)-4-prop-2-enyl(1,2,4-triazol-3-ylthio))ethan- 1-one|2-((4-allyl-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)-1-(4-chlorophenyl)ethanone|1-(4-chlorophenyl)-2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanone|1-(4-chlorophenyl)-2-{[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one

CAS: 577960-08-8
Molecular Formula C17H14ClN3O2S
Molecular Weight 359.04953 g/mol
LogP 4.3525
Topological Polar Surface Area 60.92 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 359.04953
Monoisotopic Mass 359.04953
Heavy Atoms 24
Complexity 841.36017

Chemical Identifiers

CAS Number 577960-08-8
SMILES C=CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Cl)C3=CC=CO3

Product Overview

AC1Q3IMJ (CAS 577960-08-8), with molecular formula C17H14ClN3O2S and molecular weight 359.04953 g/mol. IUPAC: 1-(4-chlorophenyl)-2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanone.

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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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