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benzamide, N-[[5-[[2-[3-(4-bromophenyl)-4,5-dihydro-5-(4-methoxyphenyl)-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-[3-(4-bromophenyl)-4,5-dihydro-5-(4-methoxyphenyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxy-
SpectraBase Compound ID 7H0dhqWFWNZ
InChI InChI=1S/C31H31BrN6O5S/c1-37-28(17-33-30(40)21-13-24(42-3)15-25(14-21)43-4)34-35-31(37)44-18-29(39)38-27(20-7-11-23(41-2)12-8-20)16-26(36-38)19-5-9-22(32)10-6-19/h5-15,27H,16-18H2,1-4H3,(H,33,40)
InChIKey JHNBCICWTRKNAP-UHFFFAOYSA-N
Mol Weight 679.59 g/mol
Molecular Formula C31H31BrN6O5S
Exact Mass 678.126002 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DiczKPN8pJE
Name benzamide, N-[[5-[[2-[3-(4-bromophenyl)-4,5-dihydro-5-(4-methoxyphenyl)-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/C31H31BrN6O5S/c1-37-28(17-33-30(40)21-13-24(42-3)15-25(14-21)43-4)34-35-31(37)44-18-29(39)38-27(20-7-11-23(41-2)12-8-20)16-26(36-38)19-5-9-22(32)10-6-19/h5-15,27H,16-18H2,1-4H3,(H,33,40)
InChIKey JHNBCICWTRKNAP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6134
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/10266739