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

Details

Stereochemistry ABSOLUTE
Molecular Formula C9H8N2S2.C2H2O4
Molecular Weight 298.338
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANTIENITE OXALATE, (R)-

SMILES

OC(=O)C(O)=O.C1[C@@H](N=C2SC=CN12)C3=CC=CS3

InChI

InChIKey=ZLLINCGFXANOHY-OGFXRTJISA-N
InChI=1S/C9H8N2S2.C2H2O4/c1-2-8(12-4-1)7-6-11-3-5-13-9(11)10-7;3-1(4)2(5)6/h1-5,7H,6H2;(H,3,4)(H,5,6)/t7-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C2H2O4
Molecular Weight 90.0349
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C9H8N2S2
Molecular Weight 208.303
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:00:21 GMT 2023
Edited
by admin
on Sat Dec 16 09:00:21 GMT 2023
Record UNII
2X332Y52LX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANTIENITE OXALATE, (R)-
Common Name English
IMIDAZO(2,1-B)THIAZOLE, 5,6-DIHYDRO-6-(2-THIENYL)-, ETHANEDIOATE (1:1), (R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
91826964
Created by admin on Sat Dec 16 09:00:21 GMT 2023 , Edited by admin on Sat Dec 16 09:00:21 GMT 2023
PRIMARY
FDA UNII
2X332Y52LX
Created by admin on Sat Dec 16 09:00:21 GMT 2023 , Edited by admin on Sat Dec 16 09:00:21 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER