4,7-Dimethyl-2-(3-oxobenzo[b]thien-2(3H)-ylidene)benzo[b]thiophen-3(2H)-one

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H12O2S2
Molecular Weight	324.417
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 4,7-Dimethyl-2-(3-oxobenzo[b]thien-2(3H)-ylidene)benzo[b]thiophen-3(2H)-one

Structure Search

SMILES

CC1=C2SC(C(=O)C2=C(C)C=C1)=C3SC4=CC=CC=C4C3=O

InChI

InChIKey=LEJFJMYRQZBWHT-ISLYRVAYSA-N

InChI=1S/C18H12O2S2/c1-9-7-8-10(2)16-13(9)15(20)18(22-16)17-14(19)11-5-3-4-6-12(11)21-17/h3-8H,1-2H3/b18-17+

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	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 18:41:08 GMT 2025` Edited by `admin` on `Tue Apr 01 18:41:08 GMT 2025`
Record UNII	D2DBJ5PP9E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Benzo[b]thiophen-3(2H)-one, 4,7-dimethyl-2-(3-oxobenzo[b]thien-2(3H)-ylidene)-

Preferred Name

English

4,7-Dimethyl-2-(3-oxobenzo[b]thien-2(3H)-ylidene)benzo[b]thiophen-3(2H)-one

Systematic Name

English

Code System Code Type Description

FDA UNII

D2DBJ5PP9E

Created by admin on Tue Apr 01 18:41:08 GMT 2025 , Edited by admin on Tue Apr 01 18:41:08 GMT 2025

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EPA CompTox

DTXSID5071595

Created by admin on Tue Apr 01 18:41:08 GMT 2025 , Edited by admin on Tue Apr 01 18:41:08 GMT 2025

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CAS

68516-80-3

Created by admin on Tue Apr 01 18:41:08 GMT 2025 , Edited by admin on Tue Apr 01 18:41:08 GMT 2025

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ECHA (EC/EINECS)

271-182-9

Created by admin on Tue Apr 01 18:41:08 GMT 2025 , Edited by admin on Tue Apr 01 18:41:08 GMT 2025

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PUBCHEM

110435

Created by admin on Tue Apr 01 18:41:08 GMT 2025 , Edited by admin on Tue Apr 01 18:41:08 GMT 2025

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