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benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxy-

View entire compound with spectra: 1 NMR

benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxy-
SpectraBase Compound ID DwGjbgAiT63
InChI InChI=1S/C29H30N6O4S2/c1-18-7-9-19(10-8-18)24-15-23(25-6-5-11-40-25)33-35(24)27(36)17-41-29-32-31-26(34(29)2)16-30-28(37)20-12-21(38-3)14-22(13-20)39-4/h5-14,24H,15-17H2,1-4H3,(H,30,37)
InChIKey KBBGELXLQDSOAJ-UHFFFAOYSA-N
Mol Weight 590.72 g/mol
Molecular Formula C29H30N6O4S2
Exact Mass 590.176996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BWBMSRCSNkT
Name benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxy-
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/C29H30N6O4S2/c1-18-7-9-19(10-8-18)24-15-23(25-6-5-11-40-25)33-35(24)27(36)17-41-29-32-31-26(34(29)2)16-30-28(37)20-12-21(38-3)14-22(13-20)39-4/h5-14,24H,15-17H2,1-4H3,(H,30,37)
InChIKey KBBGELXLQDSOAJ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6543
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/10266733