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Ethyl-S-(+)-Clopidogrel Sulfate

CAT: 0572-TRC-E904100-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-E904100-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1357474-92-0
Synonyms
(alphaS)-alpha-(2-Chlorophenyl)-6,7-dihydro-thieno[3,2-c]pyridine-5(4H)-acetic Acid Ethyl Ester Sulfate;
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
CCOC(=O)[C@@H](N1CCc2sccc2C1)c3ccccc3Cl.OS(=O)(=O)O
Molecular Formula
C17H20ClNO6S2
Molecular Weight
433.93
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Ethyl-S-(+)-Clopidogrel Sulfate
CAS Number1357474-92-0
PubChem CID129627308
IUPAC Nameethyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate;sulfuric acid
Molecular FormulaC17H20ClNO6S2
Molecular Weight433.9
Topological Polar Surface Area141
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity476
SMILES
CCOC(=O)[C@H](C1=CC=CC=C1Cl)N2CCC3=C(C2)C=CS3.OS(=O)(=O)O
InChI
InChI=1S/C17H18ClNO2S.H2O4S/c1-2-21-17(20)16(13-5-3-4-6-14(13)18)19-9-7-15-12(11-19)8-10-22-15;1-5(2,3)4/h3-6,8,10,16H,2,7,9,11H2,1H3;(H2,1,2,3,4)/t16-;/m0./s1
InChIKey
CZPQIIDIBKISIG-NTISSMGPSA-N
Chemical Structure
2D Structure
2D structure of Ethyl-S-(+)-Clopidogrel Sulfate
CAS: 1357474-92-0
CID: 129627308
Formula: C17H20ClNO6S2
MW: 433.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight433.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass433.0420574
Monoisotopic Mass433.0420574
Topological Polar Surface Area141 Ų
Heavy Atom Count27
Formal Charge0
Complexity476
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
164142Ethyl-S- (+) -Clopidogrel Sulfate
CS-P-07397Clopidogrel Ethyl Ester Sulfate
FC20513-01S- (+) -Clopidogrel hydrogen sulfate
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AR-C08136-01Ent-Clopidogrel Ethyl Ester Sulfate
sc-337638AClopidogrel sulfate
540084Clopidogrel Sulfate (racemic)
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