For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(Z)-2-(2-(4-methyl-benzenesulfonamidocarbamoyl)phenyl)-3-(1,3-diphenyl-1H-pyrazol-4-yl)acrylic acid
SpectraBase Compound ID 9IQteiWlM8E
InChI InChI=1S/C32H26N4O5S/c1-22-16-18-26(19-17-22)42(40,41)35-33-31(37)28-15-9-8-14-27(28)29(32(38)39)20-24-21-36(25-12-6-3-7-13-25)34-30(24)23-10-4-2-5-11-23/h2-21,35H,1H3,(H,33,37)(H,38,39)/b29-20-
InChIKey ISKNDTDEBIVEQQ-BRPDVVIDSA-N
Mol Weight 578.6 g/mol
Molecular Formula C32H26N4O5S
Exact Mass 578.162391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2gRQi5fhz6
Name (Z)-2-(2-(4-methyl-benzenesulfonamidocarbamoyl)phenyl)-3-(1,3-diphenyl-1H-pyrazol-4-yl)acrylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H26N4O5S
InChI InChI=1S/C32H26N4O5S/c1-22-16-18-26(19-17-22)42(40,41)35-33-31(37)28-15-9-8-14-27(28)29(32(38)39)20-24-21-36(25-12-6-3-7-13-25)34-30(24)23-10-4-2-5-11-23/h2-21,35H,1H3,(H,33,37)(H,38,39)/b29-20-
InChIKey ISKNDTDEBIVEQQ-BRPDVVIDSA-N
Literature Reference DOI 10.1080/00397911.2015.1030760
Molecular Weight 578.643 g/mol
SMILES OC(\C(c1ccccc1C(NNS(c1ccc(cc1)C)(=O)=O)=O)=C\c1c(n[n](c1)-c1ccccc1)-c1ccccc1)=O
SPLASH splash10-00mo-9010100000-6f77c32d79923bf3f6c3
Source of Spectrum SK-45-1632/SM4-6
Synonyms (Z)-3-(1,3-diphenyl-1H-pyrazol-4-yl)-2-(2-(2-tosylhydrazine-1-carbonyl)phenyl)acrylic acid
Wiley ID 1805705