3-((2-CYANOETHYL)THIO)PROPANESULPHONIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H11NO3S2
Molecular Weight	209.286
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-((2-CYANOETHYL)THIO)PROPANESULPHONIC ACID

Structure Search

SMILES

OS(=O)(=O)CCCSCCC#N

InChI

InChIKey=GOXFWRFDYIWNJD-UHFFFAOYSA-N

InChI=1S/C6H11NO3S2/c7-3-1-4-11-5-2-6-12(8,9)10/h1-2,4-6H2,(H,8,9,10)

HIDE SMILES / InChI

Molecular Formula	C6H11NO3S2
Molecular Weight	209.286
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 12:20:48 GMT 2023` Edited by `admin` on `Sat Dec 16 12:20:48 GMT 2023`
Record UNII	323Z6SU9BJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-((2-CYANOETHYL)THIO)PROPANESULPHONIC ACID

Systematic Name

English

1-PROPANESULFONIC ACID, 3-((2-CYANOETHYL)THIO)-

Common Name

English

Code System Code Type Description

FDA UNII

323Z6SU9BJ

Created by admin on Sat Dec 16 12:20:48 GMT 2023 , Edited by admin on Sat Dec 16 12:20:48 GMT 2023

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CAS

68957-68-6

Created by admin on Sat Dec 16 12:20:48 GMT 2023 , Edited by admin on Sat Dec 16 12:20:48 GMT 2023

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PUBCHEM

111918

Created by admin on Sat Dec 16 12:20:48 GMT 2023 , Edited by admin on Sat Dec 16 12:20:48 GMT 2023

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ECHA (EC/EINECS)

273-360-1

Created by admin on Sat Dec 16 12:20:48 GMT 2023 , Edited by admin on Sat Dec 16 12:20:48 GMT 2023

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EPA CompTox

DTXSID0071912

Created by admin on Sat Dec 16 12:20:48 GMT 2023 , Edited by admin on Sat Dec 16 12:20:48 GMT 2023

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