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(2E)-3-(2-benzoyl-4-chloroanilino)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-propenenitrile

View entire compound with spectra: 1 NMR

(2E)-3-(2-benzoyl-4-chloroanilino)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-propenenitrile
SpectraBase Compound ID IVzzJuRODzo
InChI InChI=1S/C25H15ClN4O3S/c26-19-9-10-22(21(12-19)24(31)16-5-2-1-3-6-16)28-14-18(13-27)25-29-23(15-34-25)17-7-4-8-20(11-17)30(32)33/h1-12,14-15,28H/b18-14+
InChIKey KKOABPXPCDZFAF-NBVRZTHBSA-N
Mol Weight 486.93 g/mol
Molecular Formula C25H15ClN4O3S
Exact Mass 486.055339 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A509nngFhNY
Name (2E)-3-(2-benzoyl-4-chloroanilino)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-propenenitrile
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/C25H15ClN4O3S/c26-19-9-10-22(21(12-19)24(31)16-5-2-1-3-6-16)28-14-18(13-27)25-29-23(15-34-25)17-7-4-8-20(11-17)30(32)33/h1-12,14-15,28H/b18-14+
InChIKey KKOABPXPCDZFAF-NBVRZTHBSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4546
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: 120578; Labnumber: ULGAP-16-5286; VK_ID: VK-004547
Synonyms 3-(2-benzoyl-4-chloroanilino)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-propenenitrile
Temperature 318 °C