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1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
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![1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d5da38eaebbc42fbbf0552315ae88b8a.png "1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone")
1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
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CAS No:
851610-39-4
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Formula:
C23H22N4OS
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Chemical Name:
1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
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Synonyms:
ZINC6683580;AKOS033940625;MCULE-9703820779;Z25398902;1-(1-benzyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one;851610-39-4
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CAS No:
1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Basic Attributes
402.5 g/mol
402.15143251 g/mol
Computed Properties
Molecular Weight:402.5
XLogP3:5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:402.15143251
Monoisotopic Mass:402.15143251
Topological Polar Surface Area:88.9
Heavy Atom Count:29
Complexity:535
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
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