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ethyl 2-({(2E)-2-cyano-3-[5-(3,4-dichlorophenyl)-2-furyl]-2-propenoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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ethyl 2-({(2E)-2-cyano-3-[5-(3,4-dichlorophenyl)-2-furyl]-2-propenoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID FxX8Wqa7jH5
InChI InChI=1S/C25H20Cl2N2O4S/c1-2-32-25(31)22-17-5-3-4-6-21(17)34-24(22)29-23(30)15(13-28)11-16-8-10-20(33-16)14-7-9-18(26)19(27)12-14/h7-12H,2-6H2,1H3,(H,29,30)/b15-11+
InChIKey STFINIHJHINUAP-RVDMUPIBSA-N
Mol Weight 515.41 g/mol
Molecular Formula C25H20Cl2N2O4S
Exact Mass 514.052084 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EbDV6DbJWpP
Name ethyl 2-({(2E)-2-cyano-3-[5-(3,4-dichlorophenyl)-2-furyl]-2-propenoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C25H20Cl2N2O4S/c1-2-32-25(31)22-17-5-3-4-6-21(17)34-24(22)29-23(30)15(13-28)11-16-8-10-20(33-16)14-7-9-18(26)19(27)12-14/h7-12H,2-6H2,1H3,(H,29,30)/b15-11+
InChIKey STFINIHJHINUAP-RVDMUPIBSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_5629
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: 121688; Labnumber: VLM0297; VK_ID: VK-005632
Synonyms ethyl 2-({2-cyano-3-[5-(3,4-dichlorophenyl)-2-furyl]-2-propenoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Temperature 318 °C