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Details

Stereochemistry ACHIRAL
Molecular Formula C34H18O2S
Molecular Weight 490.571
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3'-THIOBIS(7H-BENZ(DE)ANTHRACEN-7-ONE)

SMILES

O=C1C2=CC=CC=C2C3=C4C1=CC=CC4=C(SC5=C6C=CC=C7C(=O)C8=CC=CC=C8C(C=C5)=C67)C=C3

InChI

InChIKey=LCZJUUYGFMLYCS-UHFFFAOYSA-N
InChI=1S/C34H18O2S/c35-33-23-9-3-1-7-19(23)21-15-17-29(25-11-5-13-27(33)31(21)25)37-30-18-16-22-20-8-2-4-10-24(20)34(36)28-14-6-12-26(30)32(22)28/h1-18H

HIDE SMILES / InChI

Molecular Formula C34H18O2S
Molecular Weight 490.571
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 Tue Apr 01 19:11:36 GMT 2025
Edited
by admin
on Tue Apr 01 19:11:36 GMT 2025
Record UNII
AS23WB723Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-86170
Preferred Name English
3,3'-THIOBIS(7H-BENZ(DE)ANTHRACEN-7-ONE)
Systematic Name English
7H-BENZ(DE)ANTHRACEN-7-ONE, 3,3'-THIOBIS-
Systematic Name English
7-MESO-BENZANTHRENONE, 3,3'-THIOBIS-
Systematic Name English
3-((7-OXO-7H-BENZO(DE)ANTHRACEN-3-YL)THIO)-11B,11C-DIHYDRO-7H-BENZO(DE)ANTHRACEN-7-ONE
Systematic Name English
Code System Code Type Description
CAS
81-95-8
Created by admin on Tue Apr 01 19:11:36 GMT 2025 , Edited by admin on Tue Apr 01 19:11:36 GMT 2025
PRIMARY
EPA CompTox
DTXSID0058859
Created by admin on Tue Apr 01 19:11:36 GMT 2025 , Edited by admin on Tue Apr 01 19:11:36 GMT 2025
PRIMARY
ECHA (EC/EINECS)
201-389-1
Created by admin on Tue Apr 01 19:11:36 GMT 2025 , Edited by admin on Tue Apr 01 19:11:36 GMT 2025
PRIMARY
NSC
86170
Created by admin on Tue Apr 01 19:11:36 GMT 2025 , Edited by admin on Tue Apr 01 19:11:36 GMT 2025
PRIMARY
FDA UNII
AS23WB723Q
Created by admin on Tue Apr 01 19:11:36 GMT 2025 , Edited by admin on Tue Apr 01 19:11:36 GMT 2025
PRIMARY
PUBCHEM
66497
Created by admin on Tue Apr 01 19:11:36 GMT 2025 , Edited by admin on Tue Apr 01 19:11:36 GMT 2025
PRIMARY