ethyl 2-[[7-(4-methylphenyl)-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]acetate
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ethyl 2-[[7-(4-methylphenyl)-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]acetate
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CAS No:
371954-93-7
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Formula:
C22H22N4O3S2
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Chemical Name:
ethyl 2-[[7-(4-methylphenyl)-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]acetate
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Synonyms:
ZINC2270812;STK722159;AKOS005524141;MCULE-2900531548;371954-93-7;ethyl {[4-(4-methylphenyl)-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}acetate
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CAS No:
ethyl 2-[[7-(4-methylphenyl)-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]acetate Basic Attributes
454.6 g/mol
454.11333292 g/mol
Computed Properties
Molecular Weight:454.6
XLogP3:4.8
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:454.11333292
Monoisotopic Mass:454.11333292
Topological Polar Surface Area:131
Heavy Atom Count:31
Complexity:690
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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