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benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methoxyphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl]-2-methoxy-
SpectraBase Compound ID FQaVGYZyPbQ
InChI InChI=1S/C34H32N6O4S2/c1-22-8-6-9-24(18-22)39-31(20-35-33(42)26-10-4-5-11-29(26)44-3)36-37-34(39)46-21-32(41)40-28(23-13-15-25(43-2)16-14-23)19-27(38-40)30-12-7-17-45-30/h4-18,28H,19-21H2,1-3H3,(H,35,42)
InChIKey NTFOJEPRXQCPOJ-UHFFFAOYSA-N
Mol Weight 652.8 g/mol
Molecular Formula C34H32N6O4S2
Exact Mass 652.192646 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CguIM6gNVA4
Name benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methoxyphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl]-2-methoxy-
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/C34H32N6O4S2/c1-22-8-6-9-24(18-22)39-31(20-35-33(42)26-10-4-5-11-29(26)44-3)36-37-34(39)46-21-32(41)40-28(23-13-15-25(43-2)16-14-23)19-27(38-40)30-12-7-17-45-30/h4-18,28H,19-21H2,1-3H3,(H,35,42)
InChIKey NTFOJEPRXQCPOJ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5520
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/10257203; Labnumber: F0514-0835