ACETIC ACID 1,5-DITHIA-S-INDACEN-4-YL ESTER

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H8O2S2
Molecular Weight	248.321
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ACETIC ACID 1,5-DITHIA-S-INDACEN-4-YL ESTER

Structure Search

SMILES

CC(=O)OC1=C2C=CSC2=CC3=C1SC=C3

InChI

InChIKey=DGANHODTSBSIED-UHFFFAOYSA-N

InChI=1S/C12H8O2S2/c1-7(13)14-11-9-3-5-15-10(9)6-8-2-4-16-12(8)11/h2-6H,1H3

HIDE SMILES / InChI

Molecular Formula	C12H8O2S2
Molecular Weight	248.321
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 20:12:15 GMT 2025` Edited by `admin` on `Tue Apr 01 20:12:15 GMT 2025`
Record UNII	16HK4JIF0S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ACETIC ACID 1,5-DITHIA-S-INDACEN-4-YL ESTER

Systematic Name

English

NSC-149714

Preferred Name

English

BENZO(1,2-B:4,5-B')DITHIOPHENE-2-OL, ACETATE

Systematic Name

English

Code System Code Type Description

FDA UNII

16HK4JIF0S

Created by admin on Tue Apr 01 20:12:15 GMT 2025 , Edited by admin on Tue Apr 01 20:12:15 GMT 2025

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EPA CompTox

DTXSID90185774

Created by admin on Tue Apr 01 20:12:15 GMT 2025 , Edited by admin on Tue Apr 01 20:12:15 GMT 2025

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CAS

31937-00-5

Created by admin on Tue Apr 01 20:12:15 GMT 2025 , Edited by admin on Tue Apr 01 20:12:15 GMT 2025

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PUBCHEM

288502

Created by admin on Tue Apr 01 20:12:15 GMT 2025 , Edited by admin on Tue Apr 01 20:12:15 GMT 2025

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NSC

149714

Created by admin on Tue Apr 01 20:12:15 GMT 2025 , Edited by admin on Tue Apr 01 20:12:15 GMT 2025

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