2-[[7-(4-chlorophenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide
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![2-[[7-(4-chlorophenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8200441f77a844bebd8b760092ce4545.png "2-[[7-(4-chlorophenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide")
2-[[7-(4-chlorophenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide
structure -
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CAS No:
577962-94-8
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Formula:
C26H22ClN5O2S2
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Chemical Name:
2-[[7-(4-chlorophenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide
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Synonyms:
ZINC2385242;STK720486;AKOS005529355;MCULE-8930173779;2-{[4-(4-chlorophenyl)-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}-N-(4-methylphenyl)acetamide;577962-94-8
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CAS No:
2-[[7-(4-chlorophenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide Basic Attributes
536.1 g/mol
535.0903450 g/mol
Computed Properties
Molecular Weight:536.1
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:535.0903450
Monoisotopic Mass:535.0903450
Topological Polar Surface Area:134
Heavy Atom Count:36
Complexity:822
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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