3(2H)-Benzothiazoleacetic acid, 2-imino-6-methoxy-, ethyl ester, hydrobromide (1:1)

CAS Registry Number®

138404-44-1

CAS Name

3(2H)-Benzothiazoleacetic acid, 2-imino-6-methoxy-, ethyl ester, hydrobromide (1:1)

Molecular Formula

C12H14N2O3S.BrH

Cite this Page

3(2H)-Benzothiazoleacetic acid, 2-imino-6-methoxy-, ethyl ester, hydrobromide (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=138404-44-1 (retrieved 2024-12-05) (CAS RN: 138404-44-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H14N2O3S.BrH/c1-3-17-11(15)7-14-9-5-4-8(16-2)6-10(9)18-12(14)13;/h4-6,13H,3,7H2,1-2H3;1H

InChIKey

InChIKey=MHTXMELVRDPBNB-UHFFFAOYSA-N

SMILES

C(C(OCC)=O)N1C=2C(SC1=N)=CC(OC)=CC2.Br

Canonical SMILES

Br.O=C(OCC)CN1C(=N)SC2=CC(OC)=CC=C21

Other Names for this Substance

  • 3(2H)-Benzothiazoleacetic acid, 2-imino-6-methoxy-, ethyl ester, hydrobromide (1:1)
  • 3(2H)-Benzothiazoleacetic acid, 2-imino-6-methoxy-, ethyl ester, monohydrobromide

Deleted or Replaced CAS Registry Numbers

141366-58-7

CAS INSIGHTSTM
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