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benzamide, N-[[5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxy-
SpectraBase Compound ID 6OoiAlKdezb
InChI InChI=1S/C34H31FN6O5S2/c1-44-24-15-22(16-25(17-24)45-2)33(43)36-19-31-37-38-34(40(31)27-7-4-5-8-29(27)46-3)48-20-32(42)41-28(21-10-12-23(35)13-11-21)18-26(39-41)30-9-6-14-47-30/h4-17,28H,18-20H2,1-3H3,(H,36,43)
InChIKey JGLMJPZEPKSSES-UHFFFAOYSA-N
Mol Weight 686.8 g/mol
Molecular Formula C34H31FN6O5S2
Exact Mass 686.178139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IzcVeOTBG86
Name benzamide, N-[[5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(2-methoxyphenyl)-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/C34H31FN6O5S2/c1-44-24-15-22(16-25(17-24)45-2)33(43)36-19-31-37-38-34(40(31)27-7-4-5-8-29(27)46-3)48-20-32(42)41-28(21-10-12-23(35)13-11-21)18-26(39-41)30-9-6-14-47-30/h4-17,28H,18-20H2,1-3H3,(H,36,43)
InChIKey JGLMJPZEPKSSES-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6118
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/10266719