4,5,6,7-Tetrahydro-2-(phenylamino)-4-benzothiazolecarboxylic acid

CAS Registry Number®

40440-19-5
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CAS Name

4,5,6,7-Tetrahydro-2-(phenylamino)-4-benzothiazolecarboxylic acid

Molecular Formula

C14H14N2O2S

Molecular Mass

274.34

Cite this Page

4,5,6,7-Tetrahydro-2-(phenylamino)-4-benzothiazolecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40440-19-5 (retrieved 2024-09-10) (CAS RN: 40440-19-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    188-189 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C14H14N2O2S/c17-13(18)10-7-4-8-11-12(10)16-14(19-11)15-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,15,16)(H,17,18)

InChIKey

InChIKey=JOIXUFPFQRPNLX-UHFFFAOYSA-N

SMILES

C(O)(=O)C1C2=C(SC(NC3=CC=CC=C3)=N2)CCC1

Canonical SMILES

O=C(O)C1C=2N=C(SC2CCC1)NC=3C=CC=CC3

Other Names for this Substance

  • 4-Benzothiazolecarboxylic acid, 4,5,6,7-tetrahydro-2-(phenylamino)-
  • 4,5,6,7-Tetrahydro-2-(phenylamino)-4-benzothiazolecarboxylic acid
  • 2-Anilino-4,5,6,7-tetrahydrobenzothiazole-4-carboxylic acid
  • 2-(Phenylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylic acid