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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-(phenylmethyl)-4H-1,2,4-triazol-3-yl]methyl]-3-methyl-

View entire compound with spectra: 1 NMR

benzamide, N-[[5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(phenylmethyl)-4H-1,2,4-triazol-3-yl]methyl]-3-methyl-
SpectraBase Compound ID 9zZ7F9P2vxS
InChI InChI=1S/C33H29FN6O2S2/c1-22-7-5-10-25(17-22)32(42)35-19-30-36-37-33(39(30)20-23-8-3-2-4-9-23)44-21-31(41)40-28(24-12-14-26(34)15-13-24)18-27(38-40)29-11-6-16-43-29/h2-17,28H,18-21H2,1H3,(H,35,42)
InChIKey HHIXUXRQNGMLDI-UHFFFAOYSA-N
Mol Weight 624.8 g/mol
Molecular Formula C33H29FN6O2S2
Exact Mass 624.177745 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID APpN45msDaj
Name benzamide, N-[[5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(phenylmethyl)-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/C33H29FN6O2S2/c1-22-7-5-10-25(17-22)32(42)35-19-30-36-37-33(39(30)20-23-8-3-2-4-9-23)44-21-31(41)40-28(24-12-14-26(34)15-13-24)18-27(38-40)29-11-6-16-43-29/h2-17,28H,18-21H2,1H3,(H,35,42)
InChIKey HHIXUXRQNGMLDI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5465
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/10257120; Labnumber: F0514-4919