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Details

Stereochemistry ACHIRAL
Molecular Formula C10H8O2S2
Molecular Weight 224.299
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3H-1,2-DITHIOL-3-ONE, 5-(4-METHOXYPHENYL)-

SMILES

COC1=CC=C(C=C1)C2=CC(=O)SS2

InChI

InChIKey=WXNBNDCFQJBSCQ-UHFFFAOYSA-N
InChI=1S/C10H8O2S2/c1-12-8-4-2-7(3-5-8)9-6-10(11)14-13-9/h2-6H,1H3

HIDE SMILES / InChI

Molecular Formula C10H8O2S2
Molecular Weight 224.299
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 15:42:01 GMT 2023
Edited
by admin
on Sat Dec 16 15:42:01 GMT 2023
Record UNII
F9E7BC66MU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3H-1,2-DITHIOL-3-ONE, 5-(4-METHOXYPHENYL)-
Systematic Name English
5-(4-METHOXYPHENYL)-3H-1,2-DITHIOL-3-ONE
Systematic Name English
5-(P-METHOXYPHENYL)-1,2-DITHIOL-3-ONE
Systematic Name English
ADO
Common Name English
Code System Code Type Description
PUBCHEM
1215309
Created by admin on Sat Dec 16 15:42:02 GMT 2023 , Edited by admin on Sat Dec 16 15:42:02 GMT 2023
PRIMARY
FDA UNII
F9E7BC66MU
Created by admin on Sat Dec 16 15:42:02 GMT 2023 , Edited by admin on Sat Dec 16 15:42:02 GMT 2023
PRIMARY
CAS
831-30-1
Created by admin on Sat Dec 16 15:42:02 GMT 2023 , Edited by admin on Sat Dec 16 15:42:02 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE