2-(((1,2-BENZISOTHIAZOL-3-YLOXY)METHYL)BUTYLAMINO)ETHANOL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H20N2O2S
Molecular Weight	280.386
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(((1,2-BENZISOTHIAZOL-3-YLOXY)METHYL)BUTYLAMINO)ETHANOL

Structure Search

SMILES

CCCCN(CCO)COC1=NSC2=CC=CC=C12

InChI

InChIKey=WEWBIJGRAIWBLG-UHFFFAOYSA-N

InChI=1S/C14H20N2O2S/c1-2-3-8-16(9-10-17)11-18-14-12-6-4-5-7-13(12)19-15-14/h4-7,17H,2-3,8-11H2,1H3

HIDE SMILES / InChI

Molecular Formula	C14H20N2O2S
Molecular Weight	280.386
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 18:46:15 GMT 2023` Edited by `admin` on `Sat Dec 16 18:46:15 GMT 2023`
Record UNII	CLD53YB4XS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-(((1,2-BENZISOTHIAZOL-3-YLOXY)METHYL)BUTYLAMINO)ETHANOL

Systematic Name

English

ETHANOL, 2-(((1,2-BENZISOTHIAZOL-3-YLOXY)METHYL)BUTYLAMINO)-

Systematic Name

English

2-(1,2-BENZOTHIAZOL-3-YLOXYMETHYL(BUTYL)AMINO)ETHANOL

Systematic Name

English

Code System Code Type Description

PUBCHEM

53423483

Created by admin on Sat Dec 16 18:46:15 GMT 2023 , Edited by admin on Sat Dec 16 18:46:15 GMT 2023

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CAS

94087-25-9

Created by admin on Sat Dec 16 18:46:15 GMT 2023 , Edited by admin on Sat Dec 16 18:46:15 GMT 2023

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ECHA (EC/EINECS)

301-918-7

Created by admin on Sat Dec 16 18:46:15 GMT 2023 , Edited by admin on Sat Dec 16 18:46:15 GMT 2023

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FDA UNII

CLD53YB4XS

Created by admin on Sat Dec 16 18:46:15 GMT 2023 , Edited by admin on Sat Dec 16 18:46:15 GMT 2023

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EPA CompTox

DTXSID50240414

Created by admin on Sat Dec 16 18:46:15 GMT 2023 , Edited by admin on Sat Dec 16 18:46:15 GMT 2023

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