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Details

Stereochemistry ACHIRAL
Molecular Formula C14H10OS
Molecular Weight 226.294
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIBENZO(B,E)THIEPIN-11(6H)-ONE

SMILES

O=C1C2=CC=CC=C2SCC3=C1C=CC=C3

InChI

InChIKey=JGJDEWXZEIHBNW-UHFFFAOYSA-N
InChI=1S/C14H10OS/c15-14-11-6-2-1-5-10(11)9-16-13-8-4-3-7-12(13)14/h1-8H,9H2

HIDE SMILES / InChI

Molecular Formula C14H10OS
Molecular Weight 226.294
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 12:26:43 UTC 2023
Edited
by admin
on Sat Dec 16 12:26:43 UTC 2023
Record UNII
6U28WH7DFM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIBENZO(B,E)THIEPIN-11(6H)-ONE
Systematic Name English
6,11-Dihydrodibenz[b,e]thiepin-11-one
Systematic Name English
6,11-Dihydro-11-oxodibenzo[b,e]thiepin
Systematic Name English
DOSULEPIN HYDROCHLORIDE IMPURITY B [EP IMPURITY]
Common Name English
Homothioxanthone
Common Name English
Code System Code Type Description
PUBCHEM
73741
Created by admin on Sat Dec 16 12:26:43 UTC 2023 , Edited by admin on Sat Dec 16 12:26:43 UTC 2023
PRIMARY
FDA UNII
6U28WH7DFM
Created by admin on Sat Dec 16 12:26:43 UTC 2023 , Edited by admin on Sat Dec 16 12:26:43 UTC 2023
PRIMARY
CAS
1531-77-7
Created by admin on Sat Dec 16 12:26:43 UTC 2023 , Edited by admin on Sat Dec 16 12:26:43 UTC 2023
PRIMARY
EPA CompTox
DTXSID50165219
Created by admin on Sat Dec 16 12:26:43 UTC 2023 , Edited by admin on Sat Dec 16 12:26:43 UTC 2023
PRIMARY
ECHA (EC/EINECS)
216-241-1
Created by admin on Sat Dec 16 12:26:43 UTC 2023 , Edited by admin on Sat Dec 16 12:26:43 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY