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2-thiophenecarboxamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(4-methoxyphenyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-
SpectraBase Compound ID 5ehm7yiA0QY
InChI InChI=1S/C29H30N6O5S2/c1-34-25(16-30-28(37)24-9-6-14-41-24)31-32-29(34)42-17-26(36)35-22(20-7-5-8-23(39-3)27(20)40-4)15-21(33-35)18-10-12-19(38-2)13-11-18/h5-14,22H,15-17H2,1-4H3,(H,30,37)
InChIKey WAAWTCJQYKCOIQ-UHFFFAOYSA-N
Mol Weight 606.72 g/mol
Molecular Formula C29H30N6O5S2
Exact Mass 606.17191 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ErOWbbT8iRW
Name 2-thiophenecarboxamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(4-methoxyphenyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-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/C29H30N6O5S2/c1-34-25(16-30-28(37)24-9-6-14-41-24)31-32-29(34)42-17-26(36)35-22(20-7-5-8-23(39-3)27(20)40-4)15-21(33-35)18-10-12-19(38-2)13-11-18/h5-14,22H,15-17H2,1-4H3,(H,30,37)
InChIKey WAAWTCJQYKCOIQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5562
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/10257256; Labnumber: F0514-4750