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benzamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl]-3-methyl-
SpectraBase Compound ID HwkjqRE3Tag
InChI InChI=1S/C35H34N6O4S2/c1-22-9-5-11-24(17-22)34(43)36-20-31-37-38-35(40(31)25-12-6-10-23(2)18-25)47-21-32(42)41-28(19-27(39-41)30-15-8-16-46-30)26-13-7-14-29(44-3)33(26)45-4/h5-18,28H,19-21H2,1-4H3,(H,36,43)
InChIKey JOOVTAHENXSAGR-UHFFFAOYSA-N
Mol Weight 666.8 g/mol
Molecular Formula C35H34N6O4S2
Exact Mass 666.208296 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FQmibMljdut
Name benzamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl]-3-methyl-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C35H34N6O4S2/c1-22-9-5-11-24(17-22)34(43)36-20-31-37-38-35(40(31)25-12-6-10-23(2)18-25)47-21-32(42)41-28(19-27(39-41)30-15-8-16-46-30)26-13-7-14-29(44-3)33(26)45-4/h5-18,28H,19-21H2,1-4H3,(H,36,43)
InChIKey JOOVTAHENXSAGR-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5439
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/10257090; Labnumber: F0514-0264