1-[3-(3-quinolin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone
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![1-[3-(3-quinolin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2ada38b13247424384aeff13e9f82340.png "1-[3-(3-quinolin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone")
1-[3-(3-quinolin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone
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CAS No:
728013-73-8
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Formula:
C19H14N4OS
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Chemical Name:
1-[3-(3-quinolin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone
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Synonyms:
ZINC02226839;ZINC5789543;STK781759;STK850452;AKOS001732758;AKOS005629059;MCULE-9282134538;1-[3-(3-mercapto-5-quinolin-2-yl-4H-1,2,4-triazol-4-yl)phenyl]ethanone;1-{3-[3-(quinolin-2-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]phenyl}ethanone;1-{3-[3-(quinolin-2-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl}ethanone;728013-73-8
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CAS No:
1-[3-(3-quinolin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)phenyl]ethanone Basic Attributes
346.4 g/mol
346.08883226 g/mol
Computed Properties
Molecular Weight:346.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:346.08883226
Monoisotopic Mass:346.08883226
Topological Polar Surface Area:89.7
Heavy Atom Count:25
Complexity:578
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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