2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-nitrophenyl}acetamide
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![2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-nitrophenyl}acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4877e1134bce41a0b7d332f8fe661863.png "2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-nitrophenyl}acetamide")
2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-nitrophenyl}acetamide
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CAS No:
332175-83-4
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Formula:
C19H17N5O3S
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Chemical Name:
2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-nitrophenyl}acetamide
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Synonyms:
ZINC4286224;STK133931;AKOS000370828;MCULE-3082623035;2-((4-Allyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(4-nitrophenyl)acetamide;2-(4-Allyl-5-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(4-nitro-phenyl)-acetamide;N-(4-nitrophenyl)-2-{[5-phenyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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CAS No:
2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-nitrophenyl}acetamide Basic Attributes
395.43498
395.105
Computed Properties
Molecular Weight:395.4
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:395.10521059
Monoisotopic Mass:395.10521059
Topological Polar Surface Area:131
Heavy Atom Count:28
Complexity:544
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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