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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]-3,5-dimethoxy-

View entire compound with spectra: 1 NMR

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]-3,5-dimethoxy-
SpectraBase Compound ID 9nwRVhGxx75
InChI InChI=1S/C31H31BrN6O4S/c1-19-5-7-21(8-6-19)27-16-26(20-9-11-23(32)12-10-20)36-38(27)29(39)18-43-31-35-34-28(37(31)2)17-33-30(40)22-13-24(41-3)15-25(14-22)42-4/h5-15,27H,16-18H2,1-4H3,(H,33,40)
InChIKey KIAARWNASIHWRK-UHFFFAOYSA-N
Mol Weight 663.59 g/mol
Molecular Formula C31H31BrN6O4S
Exact Mass 662.131088 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9JKsJkxQifw
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]-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/C31H31BrN6O4S/c1-19-5-7-21(8-6-19)27-16-26(20-9-11-23(32)12-10-20)36-38(27)29(39)18-43-31-35-34-28(37(31)2)17-33-30(40)22-13-24(41-3)15-25(14-22)42-4/h5-15,27H,16-18H2,1-4H3,(H,33,40)
InChIKey KIAARWNASIHWRK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6128
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/10266731