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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]-

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]-
SpectraBase Compound ID B7XgjWRyCJy
InChI InChI=1S/C27H26N6O2S2/c1-18-10-12-19(13-11-18)22-15-21(23-9-6-14-36-23)31-33(22)25(34)17-37-27-30-29-24(32(27)2)16-28-26(35)20-7-4-3-5-8-20/h3-14,22H,15-17H2,1-2H3,(H,28,35)
InChIKey PLMKUINRDMVCQG-UHFFFAOYSA-N
Mol Weight 530.67 g/mol
Molecular Formula C27H26N6O2S2
Exact Mass 530.155866 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9RZYwFDAPjs
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]-
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/C27H26N6O2S2/c1-18-10-12-19(13-11-18)22-15-21(23-9-6-14-36-23)31-33(22)25(34)17-37-27-30-29-24(32(27)2)16-28-26(35)20-7-4-3-5-8-20/h3-14,22H,15-17H2,1-2H3,(H,28,35)
InChIKey PLMKUINRDMVCQG-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6104
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/10266700