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benzamide, N-[[5-[[2-[3-(4-bromophenyl)-4,5-dihydro-5-(4-methylphenyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-4-methoxy-
SpectraBase Compound ID H0Mbgktcaue
InChI InChI=1S/C30H29BrN6O3S/c1-19-4-6-21(7-5-19)26-16-25(20-8-12-23(31)13-9-20)35-37(26)28(38)18-41-30-34-33-27(36(30)2)17-32-29(39)22-10-14-24(40-3)15-11-22/h4-15,26H,16-18H2,1-3H3,(H,32,39)
InChIKey GZUWYOQKAAZEBA-UHFFFAOYSA-N
Mol Weight 633.57 g/mol
Molecular Formula C30H29BrN6O3S
Exact Mass 632.120523 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2E1Gntgem4n
Name benzamide, N-[[5-[[2-[3-(4-bromophenyl)-4,5-dihydro-5-(4-methylphenyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-4-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/C30H29BrN6O3S/c1-19-4-6-21(7-5-19)26-16-25(20-8-12-23(31)13-9-20)35-37(26)28(38)18-41-30-34-33-27(36(30)2)17-32-29(39)22-10-14-24(40-3)15-11-22/h4-15,26H,16-18H2,1-3H3,(H,32,39)
InChIKey GZUWYOQKAAZEBA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5526
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/10257209; Labnumber: F0514-1141