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2-{[(2E)-3-(4-methoxyphenyl)-2-propenoyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
SpectraBase Compound ID sQEqByEo0P
InChI InChI=1S/C21H24N2O3S/c1-26-15-11-8-14(9-12-15)10-13-18(24)23-21-19(20(22)25)16-6-4-2-3-5-7-17(16)27-21/h8-13H,2-7H2,1H3,(H2,22,25)(H,23,24)/b13-10+
InChIKey UMNDGBKVEDUVJC-JLHYYAGUSA-N
Mol Weight 384.49 g/mol
Molecular Formula C21H24N2O3S
Exact Mass 384.150764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EGRVwIPpRlW
Name 2-{[(2E)-3-(4-methoxyphenyl)-2-propenoyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
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/C21H24N2O3S/c1-26-15-11-8-14(9-12-15)10-13-18(24)23-21-19(20(22)25)16-6-4-2-3-5-7-17(16)27-21/h8-13H,2-7H2,1H3,(H2,22,25)(H,23,24)/b13-10+
InChIKey UMNDGBKVEDUVJC-JLHYYAGUSA-N
NMR Offset 14.4793
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UZI_26187_12661
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/8024798; Labnumber: NSB0011207; UZI_ID: UZI-012665
Synonyms 2-{[3-(4-methoxyphenyl)-2-propenoyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Temperature 313 °C