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Sulfiram (Standard)

CAT: 0804-HY-121817RSize: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-121817RSize:1 Each
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Description
Sulfiram (Standard) is the analytical standard of Sulfiram. This product is intended for research and analytical applications. Sulfiram, an ectoparasiticide, is a weak aldehyde dehydrogenase (ALDH) inhibitor. Sulfiram can be used for the study of scabies[1][2].
CAS Number
95-05-6
UNSPSC
12352211
Target
Aldehyde Dehydrogenase (ALDH) ; Parasite; Reference Standards
Type
Reference compound
Related Pathways
Anti-infection; Metabolic Enzyme/Protease; Others
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/sulfiram-standard.html
Smiles
S=C(N(CC)CC)SC(N(CC)CC)=S
Molecular Formula
C10H20N2S3
Molecular Weight
264.47
References & Citations
[1]Mays DC, et al. Photolysis of sulfiram: a mechanism for its disulfiram-like reaction. Biochem Pharmacol. 1994 Nov 16;48 (10) :1917-25.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Sulfiram

Sulfiram is an organosulfur compound.

CAS Number95-05-6
PubChem CID7215
IUPAC Namediethylcarbamothioyl N,N-diethylcarbamodithioate
Molecular FormulaC10H20N2S3
Molecular Weight264.5
XLogP3.1
Topological Polar Surface Area96
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count15
Formal Charge0
Complexity189
SMILES
CCN(CC)C(=S)SC(=S)N(CC)CC
InChI
InChI=1S/C10H20N2S3/c1-5-11(6-2)9(13)15-10(14)12(7-3)8-4/h5-8H2,1-4H3
InChIKey
CTPKSRZFJSJGML-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sulfiram
CAS: 95-05-6
CID: 7215
Formula: C10H20N2S3
MW: 264.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight264.5
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass264.07886217
Monoisotopic Mass264.07886217
Topological Polar Surface Area96 Ų
Heavy Atom Count15
Formal Charge0
Complexity189
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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