U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C22H25ClN4O2S
Molecular Weight 444.978
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of S-METHYL-DIHYDROZIPRASIDONE SULPHOXIDE

SMILES

C[S+]([O-])C1=C(C=CC=C1)C(=N)N2CCN(CCC3=CC4=C(NC(=O)C4)C=C3Cl)CC2

InChI

InChIKey=HPOSSXUVDXJKJW-UHFFFAOYSA-N
InChI=1S/C22H25ClN4O2S/c1-30(29)20-5-3-2-4-17(20)22(24)27-10-8-26(9-11-27)7-6-15-12-16-13-21(28)25-19(16)14-18(15)23/h2-5,12,14,24H,6-11,13H2,1H3,(H,25,28)

HIDE SMILES / InChI

Molecular Formula C22H25ClN4O2S
Molecular Weight 444.978
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 09:33:49 GMT 2023
Edited
by admin
on Sat Dec 16 09:33:49 GMT 2023
Record UNII
CWM555KT4Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
S-METHYL-DIHYDROZIPRASIDONE SULPHOXIDE
Common Name English
ZIPRASIDONE (M6)
Common Name English
2H-INDOL-2-ONE, 6-CHLORO-1,3-DIHYDRO-5-(2-(4-(IMINO(2-(METHYLSULFINYL)PHENYL)METHYL)-1-PIPERAZINYL)ETHYL)-
Systematic Name English
S-METHYL-DIHYDRO-ZIP-SO
Common Name English
Code System Code Type Description
FDA UNII
CWM555KT4Q
Created by admin on Sat Dec 16 09:33:49 GMT 2023 , Edited by admin on Sat Dec 16 09:33:49 GMT 2023
PRIMARY
CAS
194280-90-5
Created by admin on Sat Dec 16 09:33:49 GMT 2023 , Edited by admin on Sat Dec 16 09:33:49 GMT 2023
PRIMARY
PUBCHEM
10026520
Created by admin on Sat Dec 16 09:33:49 GMT 2023 , Edited by admin on Sat Dec 16 09:33:49 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE