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6-tert-butyl-2-{[(4-chloroanilino)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID 5d61fhmFVjd
InChI InChI=1S/C20H24ClN3O2S/c1-20(2,3)11-4-9-14-15(10-11)27-18(16(14)17(22)25)24-19(26)23-13-7-5-12(21)6-8-13/h5-8,11H,4,9-10H2,1-3H3,(H2,22,25)(H2,23,24,26)
InChIKey SQBVNVRIIBOFKX-UHFFFAOYSA-N
Mol Weight 405.94 g/mol
Molecular Formula C20H24ClN3O2S
Exact Mass 405.127776 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K8wJ5lhFukc
Name 6-tert-butyl-2-{[(4-chloroanilino)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-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/C20H24ClN3O2S/c1-20(2,3)11-4-9-14-15(10-11)27-18(16(14)17(22)25)24-19(26)23-13-7-5-12(21)6-8-13/h5-8,11H,4,9-10H2,1-3H3,(H2,22,25)(H2,23,24,26)
InChIKey SQBVNVRIIBOFKX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19253
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/9138420; UBI_ID: UBI-019256
Temperature 318 °C