2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid

CAS Registry Number®

524035-97-0

CAS Name

2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid

Molecular Formula

C17H15NO2S

Molecular Mass

297.37

Cite this Page

2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=524035-97-0 (retrieved 2024-11-25) (CAS RN: 524035-97-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    103-106 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C17H15NO2S/c19-17(20)12-21-16-11-18(10-13-6-2-1-3-7-13)15-9-5-4-8-14(15)16/h1-9,11H,10,12H2,(H,19,20)

InChIKey

InChIKey=AWNSSDYXGNZKMK-UHFFFAOYSA-N

SMILES

C(N1C=2C(C(SCC(O)=O)=C1)=CC=CC2)C3=CC=CC=C3

Canonical SMILES

O=C(O)CSC1=CN(C=2C=CC=CC12)CC=3C=CC=CC3

Other Names for this Substance

  • Acetic acid, 2-[[1-(phenylmethyl)-1H-indol-3-yl]thio]-
  • Acetic acid, [[1-(phenylmethyl)-1H-indol-3-yl]thio]-
  • 2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid
  • 1-Benzyl-3-indolylthioacetic acid
  • [(1-Benzyl-1H-indol-3-yl)thio]acetic acid

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