benzeneacetamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]methyl]-

SpectraBase Compound ID	56xMXI5FadK
InChI	InChI=1S/C36H36N6O5S2/c1-4-47-26-17-15-25(16-18-26)41-32(22-37-33(43)20-24-10-6-5-7-11-24)38-39-36(41)49-23-34(44)42-29(21-28(40-42)31-14-9-19-48-31)27-12-8-13-30(45-2)35(27)46-3/h5-19,29H,4,20-23H2,1-3H3,(H,37,43)
InChIKey	MEZOWILJGIRWTK-UHFFFAOYSA-N Google Search
Mol Weight	696.8 g/mol
Molecular Formula	C36H36N6O5S2
Exact Mass	696.218861 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	4OzwL214AT8
Name	benzeneacetamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]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/C36H36N6O5S2/c1-4-47-26-17-15-25(16-18-26)41-32(22-37-33(43)20-24-10-6-5-7-11-24)38-39-36(41)49-23-34(44)42-29(21-28(40-42)31-14-9-19-48-31)27-12-8-13-30(45-2)35(27)46-3/h5-19,29H,4,20-23H2,1-3H3,(H,37,43)
InChIKey	MEZOWILJGIRWTK-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_5460
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/10257114; Labnumber: F0514-4020