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Details

Stereochemistry ACHIRAL
Molecular Formula C23H25F3N2OS.2ClH
Molecular Weight 507.439
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of FLUPENTIXOL DIHYDROCHLORIDE, (E)-

SMILES

Cl.Cl.OCCN1CCN(CC\C=C2/C3=C(SC4=C2C=C(C=C4)C(F)(F)F)C=CC=C3)CC1

InChI

InChIKey=IOVDQEIIMOZNNA-MONHGIHASA-N
InChI=1S/C23H25F3N2OS.2ClH/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29;;/h1-2,4-8,16,29H,3,9-15H2;2*1H/b18-5+;;

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C23H25F3N2OS
Molecular Weight 434.518
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:05:16 GMT 2023
Edited
by admin
on Sat Dec 16 12:05:16 GMT 2023
Record UNII
3O4NUH2R5R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FLUPENTIXOL DIHYDROCHLORIDE, (E)-
Common Name English
1-PIPERAZINEETHANOL, 4-(3-(2-(TRIFLUOROMETHYL)-9H-THIOXANTHEN-9-YLIDENE)PROPYL)-, DIHYDROCHLORIDE, (E)-
Systematic Name English
1-PIPERAZINEETHANOL, 4-((3E)-3-(2-(TRIFLUOROMETHYL)-9H-THIOXANTHEN-9-YLIDENE)PROPYL)-, DIHYDROCHLORIDE
Systematic Name English
1-PIPERAZINEETHANOL, 4-((3E)-3-(2-(TRIFLUOROMETHYL)-9H-THIOXANTHEN-9-YLIDENE)PROPYL)-, HYDROCHLORIDE (1:2)
Systematic Name English
.BETA.-FLUPENTHIXOL DIHYDROCHLORIDE
Common Name English
TRANS-FLUPENTIXOL HYDROCHLORIDE
Common Name English
.BETA.-FLUPENTHIXOL HYDROCHLORIDE
Common Name English
Code System Code Type Description
PUBCHEM
6506406
Created by admin on Sat Dec 16 12:05:16 GMT 2023 , Edited by admin on Sat Dec 16 12:05:16 GMT 2023
PRIMARY
CAS
51529-02-3
Created by admin on Sat Dec 16 12:05:16 GMT 2023 , Edited by admin on Sat Dec 16 12:05:16 GMT 2023
PRIMARY
FDA UNII
3O4NUH2R5R
Created by admin on Sat Dec 16 12:05:16 GMT 2023 , Edited by admin on Sat Dec 16 12:05:16 GMT 2023
PRIMARY