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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H29NOS.ClH
Molecular Weight 391.998
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XENTHIORATE HYDROCHLORIDE, (S)-

SMILES

Cl.CC[C@H](C(=O)SCCN(CC)CC)C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChIKey=DMDLAKHJLZVWFB-BOXHHOBZSA-N
InChI=1S/C22H29NOS.ClH/c1-4-21(22(24)25-17-16-23(5-2)6-3)20-14-12-19(13-15-20)18-10-8-7-9-11-18;/h7-15,21H,4-6,16-17H2,1-3H3;1H/t21-;/m0./s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
(1,1'-BIPHENYL)-4-ETHANETHIOIC ACID, .ALPHA.-ETHYL-, S-(2-(DIETHYLAMINO)ETHYL) ESTER, HYDROCHLORIDE (1:1), (S)-
Preferred Name English
XENTHIORATE HYDROCHLORIDE, (S)-
Common Name English
Code System Code Type Description
FDA UNII
J9L8O5J0HE
Created by admin on Mon Mar 31 23:11:37 GMT 2025 , Edited by admin on Mon Mar 31 23:11:37 GMT 2025
PRIMARY
PUBCHEM
119026001
Created by admin on Mon Mar 31 23:11:37 GMT 2025 , Edited by admin on Mon Mar 31 23:11:37 GMT 2025
PRIMARY
NIH
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