N-(3-chloro-2-methylphenyl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
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![N-(3-chloro-2-methylphenyl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/152f684bd560458286021bd882eb715e.png "N-(3-chloro-2-methylphenyl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide")
N-(3-chloro-2-methylphenyl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
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CAS No:
768018-61-7
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Formula:
C22H22ClN3O2S2
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Chemical Name:
N-(3-chloro-2-methylphenyl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
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Synonyms:
ZINC2395108;STL342034;AKOS002190667;MCULE-5952751024;ST50082051;768018-61-7;N-(3-chloro-2-methylphenyl)-2-(4-oxo-3-prop-2-enyl(3,5,6,7,8-pentahydrobenzo[b ]thiopheno[2,3-d]pyrimidin-2-ylthio))acetamide;N-(3-chloro-2-methylphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
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CAS No:
N-(3-chloro-2-methylphenyl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide Basic Attributes
460.0 g/mol
459.0841970 g/mol
Computed Properties
Molecular Weight:460.0
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:459.0841970
Monoisotopic Mass:459.0841970
Topological Polar Surface Area:115
Heavy Atom Count:30
Complexity:719
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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