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

Details

Stereochemistry RACEMIC
Molecular Formula C19H21ClN2S.CH4O3S
Molecular Weight 441.007
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLOROTEPINE MESYLATE

SMILES

CS(O)(=O)=O.CN1CCN(CC1)C2CC3=CC=CC=C3SC4=CC=C(Cl)C=C24

InChI

InChIKey=XQRUOHZMMIUQSB-UHFFFAOYSA-N
InChI=1S/C19H21ClN2S.CH4O3S/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19;1-5(2,3)4/h2-7,13,17H,8-12H2,1H3;1H3,(H,2,3,4)

HIDE SMILES / InChI

Approval Year

Name Type Language
CLOROTEPINE MESYLATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00962538
Created by admin on Sat Dec 16 09:17:21 UTC 2023 , Edited by admin on Sat Dec 16 09:17:21 UTC 2023
PRIMARY
PUBCHEM
198244
Created by admin on Sat Dec 16 09:17:21 UTC 2023 , Edited by admin on Sat Dec 16 09:17:21 UTC 2023
PRIMARY
CAS
42505-79-3
Created by admin on Sat Dec 16 09:17:21 UTC 2023 , Edited by admin on Sat Dec 16 09:17:21 UTC 2023
PRIMARY
FDA UNII
KLU0VHS3Y4
Created by admin on Sat Dec 16 09:17:21 UTC 2023 , Edited by admin on Sat Dec 16 09:17:21 UTC 2023
PRIMARY
ECHA (EC/EINECS)
255-855-4
Created by admin on Sat Dec 16 09:17:21 UTC 2023 , Edited by admin on Sat Dec 16 09:17:21 UTC 2023
PRIMARY