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ethyl 2-(acetylamino)-6-(cyanosulfanyl)-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-(acetylamino)-6-(cyanosulfanyl)-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate structure

CAS No:
128811-96-1
Formula:
C14H14N2O4S2
Chemical Name:
ethyl 2-(acetylamino)-6-(cyanosulfanyl)-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Synonyms:
ethyl 2-(acetylamino)-7-oxo-6-thiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate;Oprea1_586926;Oprea1_792197;BBL001960;MFCD00299909;STK279850;AKOS000531219;MCULE-5806239348;VS-00965;EU-0073818

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ethyl 2-(acetylamino)-6-(cyanosulfanyl)-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Basic Attributes

Molecular Weight：

338.40196

Exact Mass：

338.039

Characteristics

PSA：

150

XLogP3：

3.1

Computed Properties

Molecular Weight:338.4
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:338.03949928
Monoisotopic Mass:338.03949928
Topological Polar Surface Area:150
Heavy Atom Count:22
Complexity:530
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-(acetylamino)-6-(cyanosulfanyl)-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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