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Details

Stereochemistry ACHIRAL
Molecular Formula C12H13ClN2OS
Molecular Weight 268.762
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(2,1-BENZISOTHIAZOL-3-YL)-4-CHLORO-N-METHYLBUTANAMIDE

SMILES

CN(C(=O)CCCCl)C1=C2C=CC=CC2=NS1

InChI

InChIKey=AGJGKJUQUHGXAD-UHFFFAOYSA-N
InChI=1S/C12H13ClN2OS/c1-15(11(16)7-4-8-13)12-9-5-2-3-6-10(9)14-17-12/h2-3,5-6H,4,7-8H2,1H3

HIDE SMILES / InChI

Molecular Formula C12H13ClN2OS
Molecular Weight 268.762
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 10:38:15 GMT 2023
Edited
by admin
on Sat Dec 16 10:38:15 GMT 2023
Record UNII
X2C2S5472N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(2,1-BENZISOTHIAZOL-3-YL)-4-CHLORO-N-METHYLBUTANAMIDE
Systematic Name English
BUTANAMIDE, N-(2,1-BENZISOTHIAZOL-3-YL)-4-CHLORO-N-METHYL-
Systematic Name English
Code System Code Type Description
CAS
68268-00-8
Created by admin on Sat Dec 16 10:38:15 GMT 2023 , Edited by admin on Sat Dec 16 10:38:15 GMT 2023
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EPA CompTox
DTXSID70987798
Created by admin on Sat Dec 16 10:38:15 GMT 2023 , Edited by admin on Sat Dec 16 10:38:15 GMT 2023
PRIMARY
PUBCHEM
16205207
Created by admin on Sat Dec 16 10:38:15 GMT 2023 , Edited by admin on Sat Dec 16 10:38:15 GMT 2023
PRIMARY
FDA UNII
X2C2S5472N
Created by admin on Sat Dec 16 10:38:15 GMT 2023 , Edited by admin on Sat Dec 16 10:38:15 GMT 2023
PRIMARY