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Details

Stereochemistry ACHIRAL
Molecular Formula C18H12O2S2
Molecular Weight 324.417
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,5-BIS(PHENYLTHIO)-2,5-CYCLOHEXADIENE-1,4-DIONE

SMILES

O=C1C=C(SC2=CC=CC=C2)C(=O)C=C1SC3=CC=CC=C3

InChI

InChIKey=CQBMMTIVMOJHSO-UHFFFAOYSA-N
InChI=1S/C18H12O2S2/c19-15-12-18(22-14-9-5-2-6-10-14)16(20)11-17(15)21-13-7-3-1-4-8-13/h1-12H

HIDE SMILES / InChI

Molecular Formula C18H12O2S2
Molecular Weight 324.417
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 12:56:58 GMT 2023
Edited
by admin
on Sat Dec 16 12:56:58 GMT 2023
Record UNII
IYZ9ZT78ZU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,5-BIS(PHENYLTHIO)-2,5-CYCLOHEXADIENE-1,4-DIONE
Systematic Name English
2,5-CYCLOHEXADIENE-1,4-DIONE, 2,5-BIS(PHENYLTHIO)-
Systematic Name English
2,5-BIS(PHENYLTHIO)-P-BENZOQUINONE
Systematic Name English
NSC-406552
Code English
2,5-BIS(PHENYLTHIO)BENZOQUINONE
Systematic Name English
P-BENZOQUINONE, 2,5-BIS(PHENYLTHIO)-
Systematic Name English
Code System Code Type Description
CAS
17058-53-6
Created by admin on Sat Dec 16 12:56:58 GMT 2023 , Edited by admin on Sat Dec 16 12:56:58 GMT 2023
PRIMARY
PUBCHEM
86928
Created by admin on Sat Dec 16 12:56:58 GMT 2023 , Edited by admin on Sat Dec 16 12:56:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID30168884
Created by admin on Sat Dec 16 12:56:58 GMT 2023 , Edited by admin on Sat Dec 16 12:56:58 GMT 2023
PRIMARY
NSC
406552
Created by admin on Sat Dec 16 12:56:58 GMT 2023 , Edited by admin on Sat Dec 16 12:56:58 GMT 2023
PRIMARY
FDA UNII
IYZ9ZT78ZU
Created by admin on Sat Dec 16 12:56:58 GMT 2023 , Edited by admin on Sat Dec 16 12:56:58 GMT 2023
PRIMARY