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3-(cyanomethylsulfanyl)-5-methylsulfanyl-1,2-thiazole-4-carbonitrile

3-(cyanomethylsulfanyl)-5-methylsulfanyl-1,2-thiazole-4-carbonitrile structure

CAS No:
24306-38-5
Formula:
C7H5N3S3
Chemical Name:
3-(cyanomethylsulfanyl)-5-methylsulfanyl-1,2-thiazole-4-carbonitrile
Synonyms:
4-Isothiazolecarbonitrile, 3-((cyanomethyl)thio)-5-(methylthio)-;24306-38-5;BRN 5939090;3-((Cyanomethyl)thio)-5-(methylthio)-4-isothiazolecarbonitrile;DTXSID00179043

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3-(cyanomethylsulfanyl)-5-methylsulfanyl-1,2-thiazole-4-carbonitrile Basic Attributes

Molecular Weight：

227.3 g/mol

Exact Mass：

226.96456069 g/mol

DSSTox ID：

DTXSID00179043

Characteristics

PSA：

139 Å²

Computed Properties

Molecular Weight:227.3
XLogP3:2.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:226.96456069
Monoisotopic Mass:226.96456069
Topological Polar Surface Area:139
Heavy Atom Count:13
Complexity:263
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(cyanomethylsulfanyl)-5-methylsulfanyl-1,2-thiazole-4-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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