2-[3-(Dimethylamino)propyl]-1,2-benzisothiazol-3(2H)-one

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H16N2OS
Molecular Weight	236.333
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-[3-(Dimethylamino)propyl]-1,2-benzisothiazol-3(2H)-one

Structure Search

SMILES

CN(C)CCCN1SC2=C(C=CC=C2)C1=O

InChI

InChIKey=OGWXHSCYJOUWCU-UHFFFAOYSA-N

InChI=1S/C12H16N2OS/c1-13(2)8-5-9-14-12(15)10-6-3-4-7-11(10)16-14/h3-4,6-7H,5,8-9H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C12H16N2OS
Molecular Weight	236.333
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 19:46:16 GMT 2025` Edited by `admin` on `Tue Apr 01 19:46:16 GMT 2025`
Record UNII	JP7G58LX4U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-[3-(Dimethylamino)propyl]-1,2-benzisothiazol-3(2H)-one

Systematic Name

English

1,2-Benzisothiazol-3(2H)-one, 2-[3-(dimethylamino)propyl]-

Preferred Name

English

Code System Code Type Description

ECHA (EC/EINECS)

242-219-6

Created by admin on Tue Apr 01 19:46:16 GMT 2025 , Edited by admin on Tue Apr 01 19:46:16 GMT 2025

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CAS

18339-14-5

Created by admin on Tue Apr 01 19:46:16 GMT 2025 , Edited by admin on Tue Apr 01 19:46:16 GMT 2025

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FDA UNII

JP7G58LX4U

Created by admin on Tue Apr 01 19:46:16 GMT 2025 , Edited by admin on Tue Apr 01 19:46:16 GMT 2025

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PUBCHEM

87588

Created by admin on Tue Apr 01 19:46:16 GMT 2025 , Edited by admin on Tue Apr 01 19:46:16 GMT 2025

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EPA CompTox

DTXSID30171419

Created by admin on Tue Apr 01 19:46:16 GMT 2025 , Edited by admin on Tue Apr 01 19:46:16 GMT 2025

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