2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(1H-pyrrol-2-yl)ethanone
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![2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(1H-pyrrol-2-yl)ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ab095342b1e64bedb2d051c020785705.png "2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(1H-pyrrol-2-yl)ethanone")
2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(1H-pyrrol-2-yl)ethanone
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CAS No:
762257-98-7
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Formula:
C21H18N4O2S
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Chemical Name:
2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(1H-pyrrol-2-yl)ethanone
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Synonyms:
MLS000389900;CHEMBL1548657;HMS2580L06;ZINC2623704;AKOS033676807;MCULE-7168995358;SMR000256174;Z19347440;2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-pyrrol-2-yl)ethan-1-one;762257-98-7
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CAS No:
2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(1H-pyrrol-2-yl)ethanone Basic Attributes
390.5 g/mol
390.11504700 g/mol
Computed Properties
Molecular Weight:390.5
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:390.11504700
Monoisotopic Mass:390.11504700
Topological Polar Surface Area:98.1
Heavy Atom Count:28
Complexity:509
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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