Identita

Clopidogrel Sulfonated Impurity

CAS 2173294-69-2 · C16H16ClNO5S2

01Identita

Lazychem IDLC-11307
CAS RN2173294-69-2
PubChem CID152546549
Molecular formulaC16H16ClNO5S2
Molecular weight401.88 g/mol
IUPAC name(S)-5-(1-(2-chlorophenyl)-2-methoxy-2-oxoethyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-sulfonic acid
InChIKeyYMPHZRZZMLUNKA-HNNXBMFYSA-N

02Struktura a stereochemie

2D structurePubChem CID 152546549
Two-dimensional chemical structure of Clopidogrel Sulfonated Impurity, CAS 2173294-69-2
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres1
Ring count3
Secondary amines0
Tertiary amines1
SMILESCOC(=O)[C@H](C1=CC=CC=C1Cl)N2CCC3=C(C2)C=C(S3)S(=O)(=O)O
InChINeuvedeno

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04Stav v Indii

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Názvy a vztahy

API a mateřské léčivo

Clopidogrel

Nečistoty a související sloučeniny

Názvy a vztahy

  • 5-Methyl (alphaS)-alpha-(2-chlorophenyl)-6,7-dihydro-2-sulfothieno[3,2-c]pyridine-5(4H)-acetate
  • 2173294-69-2
  • Clopidogrel Sulfonated Impurity
  • (S)-5-(1-(2-chlorophenyl)-2-methoxy-2-oxoethyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-sulfonic acid
  • Clopidogrel Impurity 22
  • W3VN9AG8WK
  • SCHEMBL28412253
  • CS-0165237
  • (S)-5-(1-(2-chlorophenyl)-2-methoxy-2-oxoethyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-sulfonic acid? (Clopidogrel Impurity pound(c)
  • Thieno[3,2-c]pyridine-5(4H)-acetic acid, alpha-(2-chlorophenyl)-6,7-dihydro-2-sulfo-, 5-methyl ester, (alphaS)-

Nečistoty a související sloučeniny

06Zdroje