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ethyl 4,5-dimethyl-2-{[({(4E)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-1-phenyl-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-3-thiophenecarboxylate

View entire compound with spectra: 1 NMR

ethyl 4,5-dimethyl-2-{[({(4E)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-1-phenyl-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-3-thiophenecarboxylate
SpectraBase Compound ID ACTL0s7XFcm
InChI InChI=1S/C25H25N5O4S2/c1-5-34-24(33)21-15(2)16(3)36-22(21)28-20(31)14-35-25-27-19(11-17-12-26-29(4)13-17)23(32)30(25)18-9-7-6-8-10-18/h6-13H,5,14H2,1-4H3,(H,28,31)/b19-11+
InChIKey HIYFUIQHCMRISZ-YBFXNURJSA-N
Mol Weight 523.63 g/mol
Molecular Formula C25H25N5O4S2
Exact Mass 523.134797 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1fIb6dvfL6b
Name ethyl 4,5-dimethyl-2-{[({(4E)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-1-phenyl-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-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/C25H25N5O4S2/c1-5-34-24(33)21-15(2)16(3)36-22(21)28-20(31)14-35-25-27-19(11-17-12-26-29(4)13-17)23(32)30(25)18-9-7-6-8-10-18/h6-13H,5,14H2,1-4H3,(H,28,31)/b19-11+
InChIKey HIYFUIQHCMRISZ-YBFXNURJSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11597
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/1266824; Labnumber: NIV1645; UZI_ID: UZI-011599
Synonyms ethyl 4,5-dimethyl-2-{[({4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-1-phenyl-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-3-thiophenecarboxylate
Temperature 308 °C