1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone
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![1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/fbc88b37aa3247b4b04c4becf664dc16.png "1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone")
1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone
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CAS No:
332019-57-5
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Formula:
C17H16N4O2S4
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Chemical Name:
1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone
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Synonyms:
1-(8-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone;2-(1H-1,2,4-triazol-5-ylthio)-1-(8-methoxy-4,4-dimethyl-1-thioxo(4,5-dihydro-1 ,2-dithioleno[5,4-c]quinolin-5-yl))ethan-1-one;8-methoxy-4,4-dimethyl-5-[(4H-1,2,4-triazol-3-ylthio)acetyl]-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione;CBMicro_004555;ChemDiv1_007157;HMS607F07;SMSF0017331;ZINC3770968;STK063974;AKOS000620158;AKOS002239040;CB06480;MCULE-1721958859;ST034226;BIM-0004675.P001;AB00094317-01;SR-01000465533;SR-01000465533-1;332019-57-5
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CAS No:
1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Basic Attributes
436.6 g/mol
436.01561046 g/mol
Computed Properties
Molecular Weight:436.6
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:436.01561046
Monoisotopic Mass:436.01561046
Topological Polar Surface Area:179
Heavy Atom Count:27
Complexity:671
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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