Clopidogrel

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Systematic / IUPAC Name: Methyl (2-chlorophenyl)(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetate

ID: Reference672

Other Names: Thieno(3,2-c)pyridine-5(4H)-acetic acid, α-(2-chlorophenyl)-6,7-dihydro-, methyl ester, (S)-;
(S)-Methyl 2-(2-chlorophenyl)-2-(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetate;
Methyl (2S)-2-(2-chlorophenyl)-2-{4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetate;
Plavix;
(S)-Clopidogrel

Formula: C16H16ClNO2S

Class: Therapeutics/Prescription Drugs

Spectral Data

Clopidogrel mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 99
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/19/2015 11:54:02 AM
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Identificators

InChI InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3/t15-/m0/s1
InChI Key GKTWGGQPFAXNFI-HNNXBMFYSA-N
Canonical SMILES COC(=O)C(C1=CC=CC=C1Cl)N2CCC3=C(C2)C=CS3
CAS 113665842
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Other Names Thieno(3,2-c)pyridine-5(4H)-acetic acid, α-(2-chlorophenyl)-6,7-dihydro-, methyl ester, (S)-;
(S)-Methyl 2-(2-chlorophenyl)-2-(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetate;
Methyl (2S)-2-(2-chlorophenyl)-2-{4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetate;
Plavix;
(S)-Clopidogrel

In Other Databases

DrugBank APRD00444
ChemIDPlus 113665842
ChEMBL CHEMBL1771
KEGG D07729
PubChem 60606
Wikipedia Clopidogrel
ChemSpider 54632
HMDb HMDB05011
ChEBI CHEBI:37941