2-(((2-HYDROXYETHYL)METHYLAMINO)METHYL)-1,2-BENZISOTHIAZOL-3(2H)-ONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H14N2O2S
Molecular Weight	238.306
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(((2-HYDROXYETHYL)METHYLAMINO)METHYL)-1,2-BENZISOTHIAZOL-3(2H)-ONE

Structure Search

SMILES

CN(CCO)CN1SC2=CC=CC=C2C1=O

InChI

InChIKey=ZFGLHALAVZEHQD-UHFFFAOYSA-N

InChI=1S/C11H14N2O2S/c1-12(6-7-14)8-13-11(15)9-4-2-3-5-10(9)16-13/h2-5,14H,6-8H2,1H3

HIDE SMILES / InChI

Molecular Formula	C11H14N2O2S
Molecular Weight	238.306
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 10:37:40 GMT 2023` Edited by `admin` on `Sat Dec 16 10:37:40 GMT 2023`
Record UNII	5W0DQC0X0D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-(((2-HYDROXYETHYL)METHYLAMINO)METHYL)-1,2-BENZISOTHIAZOL-3(2H)-ONE

Systematic Name

English

1,2-BENZISOTHIAZOL-3(2H)-ONE, 2-(((2-HYDROXYETHYL)METHYLAMINO)METHYL)-

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

285-137-6

Created by admin on Sat Dec 16 10:37:40 GMT 2023 , Edited by admin on Sat Dec 16 10:37:40 GMT 2023

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PUBCHEM

53423486

Created by admin on Sat Dec 16 10:37:40 GMT 2023 , Edited by admin on Sat Dec 16 10:37:40 GMT 2023

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FDA UNII

5W0DQC0X0D

Created by admin on Sat Dec 16 10:37:40 GMT 2023 , Edited by admin on Sat Dec 16 10:37:40 GMT 2023

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CAS

85030-12-2

Created by admin on Sat Dec 16 10:37:40 GMT 2023 , Edited by admin on Sat Dec 16 10:37:40 GMT 2023

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EPA CompTox

DTXSID101005393

Created by admin on Sat Dec 16 10:37:40 GMT 2023 , Edited by admin on Sat Dec 16 10:37:40 GMT 2023

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