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

Details

Stereochemistry ABSOLUTE
Molecular Formula C13H20N2O3S.ClH
Molecular Weight 320.835
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

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

SMILES

Cl.CCOC(=O)\C=C1/S[C@@H](N2CCCCC2)C(=O)N1C

InChI

InChIKey=AOHAFCXGDWOODX-CIONHTPMSA-N
InChI=1S/C13H20N2O3S.ClH/c1-3-18-11(16)9-10-14(2)12(17)13(19-10)15-7-5-4-6-8-15;/h9,13H,3-8H2,1-2H3;1H/b10-9-;/t13-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C13H20N2O3S
Molecular Weight 284.374
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:54:21 GMT 2023
Edited
by admin
on Sat Dec 16 01:54:21 GMT 2023
Record UNII
MY882A8T0D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETOZOLIN HYDROCHLORIDE, (R)-
Common Name English
ACETIC ACID, 2-(3-METHYL-4-OXO-5-(1-PIPERIDINYL)-2-THIAZOLIDINYLIDENE)-, ETHYL ESTER, HYDROCHLORIDE (1:1), (R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76972807
Created by admin on Sat Dec 16 01:54:21 GMT 2023 , Edited by admin on Sat Dec 16 01:54:21 GMT 2023
PRIMARY
FDA UNII
MY882A8T0D
Created by admin on Sat Dec 16 01:54:21 GMT 2023 , Edited by admin on Sat Dec 16 01:54:21 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER