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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H21NOS.ClH
Molecular Weight 287.849
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESPROQUIN HYDROCHLORIDE, (R)-

SMILES

Cl.CC[S@@+]([O-])CCCN1CCC2=CC=CC=C2C1

InChI

InChIKey=ATLSSFQKJXKSHB-UNTBIKODSA-N
InChI=1S/C14H21NOS.ClH/c1-2-17(16)11-5-9-15-10-8-13-6-3-4-7-14(13)12-15;/h3-4,6-7H,2,5,8-12H2,1H3;1H/t17-;/m1./s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
ESPROQUIN HYDROCHLORIDE, (R)-
Common Name English
ISOQUINOLINE, 2-(3-(ETHYLSULFINYL)PROPYL)-1,2,3,4-TETRAHYDRO-, HYDROCHLORIDE (1:1), (R)-
Preferred Name English
Code System Code Type Description
FDA UNII
1GGW4I15CX
Created by admin on Mon Mar 31 20:53:49 GMT 2025 , Edited by admin on Mon Mar 31 20:53:49 GMT 2025
PRIMARY
PUBCHEM
124220590
Created by admin on Mon Mar 31 20:53:49 GMT 2025 , Edited by admin on Mon Mar 31 20:53:49 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966