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2-(4-{(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)-N-(4-methylphenyl)acetamide

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2-(4-{(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)-N-(4-methylphenyl)acetamide
SpectraBase Compound ID 5GCemVhQKs5
InChI InChI=1S/C25H26N4O4/c1-4-32-23-15-19(14-21-18(3)28-29(25(21)31)13-5-12-26)8-11-22(23)33-16-24(30)27-20-9-6-17(2)7-10-20/h6-11,14-15H,4-5,13,16H2,1-3H3,(H,27,30)/b21-14-
InChIKey UCWKZEVFMKPCPR-STZFKDTASA-N
Mol Weight 446.51 g/mol
Molecular Formula C25H26N4O4
Exact Mass 446.195405 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LL9LQbCqyJI
Name 2-(4-{(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)-N-(4-methylphenyl)acetamide
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/C25H26N4O4/c1-4-32-23-15-19(14-21-18(3)28-29(25(21)31)13-5-12-26)8-11-22(23)33-16-24(30)27-20-9-6-17(2)7-10-20/h6-11,14-15H,4-5,13,16H2,1-3H3,(H,27,30)/b21-14-
InChIKey UCWKZEVFMKPCPR-STZFKDTASA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6460
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/8184848; UBI_ID: UBI-006462
Synonyms 2-(4-{[1-(2-cyanoethyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)-N-(4-methylphenyl)acetamide
Temperature 308 °C