N-[[(12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]carbamothioyl]-4-methoxybenzamide
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![N-[[(12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]carbamothioyl]-4-methoxybenzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4557dd90e50c48989bee65e3ae636a26.png "N-[[(12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]carbamothioyl]-4-methoxybenzamide")
N-[[(12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]carbamothioyl]-4-methoxybenzamide
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CAS No:
848059-39-2
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Formula:
C21H23N5O3S3
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Chemical Name:
N-[[(12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]carbamothioyl]-4-methoxybenzamide
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Synonyms:
C21H23N5O3S3;ZINC2421336;STL345332;AKOS022121222;MCULE-7318855032;848059-39-2;N-({2-[6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]hydrazinyl}carbonothioyl)-4-methoxybenzamide
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CAS No:
N-[[(12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]carbamothioyl]-4-methoxybenzamide Basic Attributes
489.6 g/mol
489.09630313 g/mol
Computed Properties
Molecular Weight:489.6
XLogP3:5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:489.09630313
Monoisotopic Mass:489.09630313
Topological Polar Surface Area:183
Heavy Atom Count:32
Complexity:692
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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