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ethyl 2-[({[5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5-dimethyl-3-thiophenecarboxylate

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ethyl 2-[({[5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
SpectraBase Compound ID E3UG3uIUWid
InChI InChI=1S/C26H30N6O4S2/c1-7-35-19-11-9-18(10-12-19)32-23(20-13-15(3)30-31(20)6)28-29-26(32)37-14-21(33)27-24-22(25(34)36-8-2)16(4)17(5)38-24/h9-13H,7-8,14H2,1-6H3,(H,27,33)
InChIKey MDIUCIRWCKONFA-UHFFFAOYSA-N
Mol Weight 554.68 g/mol
Molecular Formula C26H30N6O4S2
Exact Mass 554.176996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H3wtrJHT0ft
Name ethyl 2-[({[5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
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/C26H30N6O4S2/c1-7-35-19-11-9-18(10-12-19)32-23(20-13-15(3)30-31(20)6)28-29-26(32)37-14-21(33)27-24-22(25(34)36-8-2)16(4)17(5)38-24/h9-13H,7-8,14H2,1-6H3,(H,27,33)
InChIKey MDIUCIRWCKONFA-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11345
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: UZI/1032027; Labnumber: NIV1121; UZI_ID: UZI-011347
Temperature 308 °C