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Details

Stereochemistry ACHIRAL
Molecular Formula C21H19ClN4O2S
Molecular Weight 426.919
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-OXO ZIPRASIDONE

SMILES

ClC1=CC2=C(C=C1CCN3CCN(CC3)C4=NSC5=C4C=CC=C5)C(=O)C(=O)N2

InChI

InChIKey=VWHQRPYTDLERQO-UHFFFAOYSA-N
InChI=1S/C21H19ClN4O2S/c22-16-12-17-15(19(27)21(28)23-17)11-13(16)5-6-25-7-9-26(10-8-25)20-14-3-1-2-4-18(14)29-24-20/h1-4,11-12H,5-10H2,(H,23,27,28)

HIDE SMILES / InChI

Molecular Formula C21H19ClN4O2S
Molecular Weight 426.919
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:56:41 UTC 2023
Edited
by admin
on Sat Dec 16 10:56:41 UTC 2023
Record UNII
7C2079297J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-OXO ZIPRASIDONE
Common Name English
ZIPRASIDONE RELATED COMPOUND B [USP-RS]
Common Name English
5-(2-(4-(1,2-BENZISOTHIAZOL-3-YL)PIPERAZIN-1-YL)ETHYL)-6-CHLORO-1H-INDOLE-2,3-DIONE
Systematic Name English
ZIPRASIDONE MESILATE TRIHYDRATE IMPURITY B [EP IMPURITY]
Common Name English
ZIPRASIDONE HYDROCHLORIDE MONOHYDRATE IMPURITY B [EP IMPURITY]
Common Name English
1H-INDOLE-2,3-DIONE, 5-(2-(4-(1,2-BENZISOTHIAZOL-3-YL)-1-PIPERAZINYL)ETHYL)-6-CHLORO-
Systematic Name English
ZIPRASIDONE RELATED COMPOUND B
Common Name English
ZIPRASIDONE RELATED COMPOUND B [USP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
46782656
Created by admin on Sat Dec 16 10:56:41 UTC 2023 , Edited by admin on Sat Dec 16 10:56:41 UTC 2023
PRIMARY
FDA UNII
7C2079297J
Created by admin on Sat Dec 16 10:56:41 UTC 2023 , Edited by admin on Sat Dec 16 10:56:41 UTC 2023
PRIMARY
CAS
1159977-56-6
Created by admin on Sat Dec 16 10:56:41 UTC 2023 , Edited by admin on Sat Dec 16 10:56:41 UTC 2023
PRIMARY
EPA CompTox
DTXSID50151253
Created by admin on Sat Dec 16 10:56:41 UTC 2023 , Edited by admin on Sat Dec 16 10:56:41 UTC 2023
PRIMARY
RS_ITEM_NUM
1724420
Created by admin on Sat Dec 16 10:56:41 UTC 2023 , Edited by admin on Sat Dec 16 10:56:41 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP