N-(2,4-dichlorophenyl)-2-[(12,12-dimethyl-3-oxo-4-prop-2-enyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetamide
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![N-(2,4-dichlorophenyl)-2-[(12,12-dimethyl-3-oxo-4-prop-2-enyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5c40dbdc5fbd4086bde9a55d59970ee7.png "N-(2,4-dichlorophenyl)-2-[(12,12-dimethyl-3-oxo-4-prop-2-enyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetamide")
N-(2,4-dichlorophenyl)-2-[(12,12-dimethyl-3-oxo-4-prop-2-enyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetamide
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CAS No:
488734-11-8
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Formula:
C22H21Cl2N3O2S3
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Chemical Name:
N-(2,4-dichlorophenyl)-2-[(12,12-dimethyl-3-oxo-4-prop-2-enyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetamide
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Synonyms:
C22H21Cl2N3O2S3;ZINC1759556;STK544022;AKOS005473273;MCULE-7509705981;488734-11-8;N-(2,4-dichlorophenyl)-2-{[6,6-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
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CAS No:
N-(2,4-dichlorophenyl)-2-[(12,12-dimethyl-3-oxo-4-prop-2-enyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetamide Basic Attributes
526.5 g/mol
525.0172958 g/mol
Computed Properties
Molecular Weight:526.5
XLogP3:5.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:525.0172958
Monoisotopic Mass:525.0172958
Topological Polar Surface Area:141
Heavy Atom Count:32
Complexity:796
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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