2-[[[2-[(Phenylamino)sulfonyl]ethyl](3-pyridinylmethyl)amino]carbonyl]benzoic acid

CAS Registry Number®

1306738-74-8
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CAS Name

2-[[[2-[(Phenylamino)sulfonyl]ethyl](3-pyridinylmethyl)amino]carbonyl]benzoic acid

Molecular Formula

C22H21N3O5S

Molecular Mass

439.48

Cite this Page

2-[[[2-[(Phenylamino)sulfonyl]ethyl](3-pyridinylmethyl)amino]carbonyl]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1306738-74-8 (retrieved 2024-09-06) (CAS RN: 1306738-74-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H21N3O5S/c26-21(19-10-4-5-11-20(19)22(27)28)25(16-17-7-6-12-23-15-17)13-14-31(29,30)24-18-8-2-1-3-9-18/h1-12,15,24H,13-14,16H2,(H,27,28)

InChIKey

InChIKey=UQLQZJMVMDHRHS-UHFFFAOYSA-N

SMILES

C(N(CC=1C=CC=NC1)CCS(NC2=CC=CC=C2)(=O)=O)(=O)C3=C(C(O)=O)C=CC=C3

Canonical SMILES

O=C(O)C=1C=CC=CC1C(=O)N(CC=2C=NC=CC2)CCS(=O)(=O)NC=3C=CC=CC3

Other Names for this Substance

  • Benzoic acid, 2-[[[2-[(phenylamino)sulfonyl]ethyl](3-pyridinylmethyl)amino]carbonyl]-
  • 2-[[[2-[(Phenylamino)sulfonyl]ethyl](3-pyridinylmethyl)amino]carbonyl]benzoic acid