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Details

Stereochemistry ACHIRAL
Molecular Formula C8H11NO2S.ClH
Molecular Weight 221.704
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RO-22-0654 HYDROCHLORIDE

SMILES

Cl.CCC1=C(N)C(=CS1)C(=O)OC

InChI

InChIKey=IFDLYTVTWMMYFZ-UHFFFAOYSA-N
InChI=1S/C8H11NO2S.ClH/c1-3-6-7(9)5(4-12-6)8(10)11-2;/h4H,3,9H2,1-2H3;1H

HIDE SMILES / InChI

Approval Year

Name Type Language
RO-22-0654/001
Preferred Name English
RO-22-0654 HYDROCHLORIDE
Code English
3-THIOPHENECARBOXYLIC ACID, 4-AMINO-5-ETHYL-, METHYL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
KHD9TJ73LU
Created by admin on Mon Mar 31 17:35:56 GMT 2025 , Edited by admin on Mon Mar 31 17:35:56 GMT 2025
PRIMARY
IUPHAR
6917726
Created by admin on Mon Mar 31 17:35:56 GMT 2025 , Edited by admin on Mon Mar 31 17:35:56 GMT 2025
PRIMARY
CAS
66319-20-8
Created by admin on Mon Mar 31 17:35:56 GMT 2025 , Edited by admin on Mon Mar 31 17:35:56 GMT 2025
PRIMARY
PUBCHEM
6917726
Created by admin on Mon Mar 31 17:35:56 GMT 2025 , Edited by admin on Mon Mar 31 17:35:56 GMT 2025
PRIMARY