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ethyl 2-(benzoylcarbamothioylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylate

ethyl 2-(benzoylcarbamothioylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylate structure

CAS No:
402562-39-4
Formula:
C20H22N2O3S3
Chemical Name:
ethyl 2-(benzoylcarbamothioylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylate
Synonyms:
ZINC1832447;STL297808;AKOS022108500;MCULE-9036729845;402562-39-4;ethyl 5,5-dimethyl-2-{[(phenylcarbonyl)carbamothioyl]amino}-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carboxylate

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ethyl 2-(benzoylcarbamothioylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylate Basic Attributes

Molecular Weight：

434.6 g/mol

Exact Mass：

434.07925609 g/mol

Characteristics

PSA：

153 Å²

Computed Properties

Molecular Weight:434.6
XLogP3:4.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:434.07925609
Monoisotopic Mass:434.07925609
Topological Polar Surface Area:153
Heavy Atom Count:28
Complexity:608
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-(benzoylcarbamothioylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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