(Q27278051)

CLOPENTHIXOL (English)

14 October 2016

chemical formula

C₂₂H₂₅ClN₂OS

1 reference

CLOPENTHIXOL (English)

14 October 2016

canonical SMILES

C1CN(CCN1CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO

1 reference

CLOPENTHIXOL (English)

14 October 2016

isomeric SMILES

C1CN(CCN1CC/C=C/2\C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO

1 reference

CLOPENTHIXOL (English)

InChI=1S/C22H25ClN2OS/c23-17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)27-22)5-3-9-24-10-12-25(13-11-24)14-15-26/h1-2,4-8,16,26H,3,9-15H2/b18-5+

14 October 2016

Identifiers

InChI

1 reference

CLOPENTHIXOL (English)

WFPIAZLQTJBIFN-BLLMUTORSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

CLOPENTHIXOL (English)

14 October 2016

2 references

UNII

FLE878A8ZI

transclopenthixol (English)

WFPIAZLQTJBIFN-BLLMUTORSA-N

14 October 2016

InChIKey

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=53772-84-2

1 reference

2-{4-[(3E)-3-(2-Chloro-9H-thioxanthen-9-ylidene)propyl]-1-piperazinyl}ethanol (English)

14 October 2016

1 reference

CLOPENTHIXOL (English)

14 October 2016

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

ZUCLOPENTHIXOL (English)

14 October 2016

1 reference

1 reference

DSSTOX compound identifier

0 references

1 reference

Global Substance Registration System

UNII

FLE878A8ZI

transclopenthixol (English)