2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
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![2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8517e19a961e4fa1a45e87e08cbc4dd8.png "2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide")
2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
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CAS No:
849029-72-7
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Formula:
C20H16ClF3N4OS
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Chemical Name:
2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
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Synonyms:
ZINC2454062;STL293762;AKOS002993782;MCULE-4601590270;2-{[5-(4-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide;ST50424501;2-[5-(4-chlorophenyl)-4-prop-2-enyl(1,2,4-triazol-3-ylthio)]-N-[3-(trifluorome thyl)phenyl]acetamide;849029-72-7
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CAS No:
2-[[5-(4-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide Basic Attributes
452.9 g/mol
452.0685445 g/mol
Computed Properties
Molecular Weight:452.9
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:452.0685445
Monoisotopic Mass:452.0685445
Topological Polar Surface Area:85.1
Heavy Atom Count:30
Complexity:589
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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