2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
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![2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c08a6fe85fed469e8f1608c38d34f95b.png "2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile")
2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
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CAS No:
309278-35-1
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Formula:
C24H29N3O2S
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Chemical Name:
2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
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Synonyms:
2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile;ChemDiv1_011739;Oprea1_407037;Oprea1_869312;HMS620F13;RSC000188;STK700055;AKOS000598346;AKOS016349013;MCULE-8161751443
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CAS No:
2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile Basic Attributes
423.57096
423.198
Computed Properties
Molecular Weight:423.6
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:423.19804835
Monoisotopic Mass:423.19804835
Topological Polar Surface Area:119
Heavy Atom Count:30
Complexity:870
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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