benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl]-2-methoxy-

SpectraBase Compound ID	AYctLE7kGuJ
InChI	InChI=1S/C35H34N6O3S2/c1-24-14-16-26(17-15-24)29-21-28(31-13-8-20-45-31)39-41(29)33(42)23-46-35-38-37-32(40(35)19-18-25-9-4-3-5-10-25)22-36-34(43)27-11-6-7-12-30(27)44-2/h3-17,20,29H,18-19,21-23H2,1-2H3,(H,36,43)
InChIKey	MSWNNPMURDQMEI-UHFFFAOYSA-N Google Search
Mol Weight	650.8 g/mol
Molecular Formula	C35H34N6O3S2
Exact Mass	650.213381 g/mol

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SpectraBase Spectrum ID	EhrdN3HFwDQ
Name	benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl]-2-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/C35H34N6O3S2/c1-24-14-16-26(17-15-24)29-21-28(31-13-8-20-45-31)39-41(29)33(42)23-46-35-38-37-32(40(35)19-18-25-9-4-3-5-10-25)22-36-34(43)27-11-6-7-12-30(27)44-2/h3-17,20,29H,18-19,21-23H2,1-2H3,(H,36,43)
InChIKey	MSWNNPMURDQMEI-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_5571
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/10257272; Labnumber: F0514-5220