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ethyl 5-acetyl-2-({(Z)-2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methyl-3-thiophenecarboxylate
SpectraBase Compound ID GmYmdSzis1M
InChI InChI=1S/C22H17Cl2N3O3S2/c1-4-30-22(29)18-11(2)19(12(3)28)32-21(18)26-9-14(8-25)20-27-17(10-31-20)13-5-6-15(23)16(24)7-13/h5-7,9-10,26H,4H2,1-3H3/b14-9-
InChIKey JMPGUOGUEZFIIN-ZROIWOOFSA-N
Mol Weight 506.42 g/mol
Molecular Formula C22H17Cl2N3O3S2
Exact Mass 505.008839 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AwX7tXvtXdj
Name ethyl 5-acetyl-2-({(Z)-2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methyl-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/C22H17Cl2N3O3S2/c1-4-30-22(29)18-11(2)19(12(3)28)32-21(18)26-9-14(8-25)20-27-17(10-31-20)13-5-6-15(23)16(24)7-13/h5-7,9-10,26H,4H2,1-3H3/b14-9-
InChIKey JMPGUOGUEZFIIN-ZROIWOOFSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23686
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: D43445; Labnumber: ULGA9-0012; SBI_ID: SBI-023690
Synonyms ethyl 5-acetyl-2-({2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methyl-3-thiophenecarboxylate
Temperature 318 °C