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N-cyclohexyl-2-{[(E)-(6-methyl-1,3-benzodioxol-5-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID qRuolKlpkF
InChI InChI=1S/C24H28N2O3S/c1-15-11-19-20(29-14-28-19)12-16(15)13-25-24-22(18-9-5-6-10-21(18)30-24)23(27)26-17-7-3-2-4-8-17/h11-13,17H,2-10,14H2,1H3,(H,26,27)/b25-13+
InChIKey YFDUYZFYLBOJKR-DHRITJCHSA-N
Mol Weight 424.56 g/mol
Molecular Formula C24H28N2O3S
Exact Mass 424.182064 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KEiVFlESjCs
Name N-cyclohexyl-2-{[(E)-(6-methyl-1,3-benzodioxol-5-yl)methylidene]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/C24H28N2O3S/c1-15-11-19-20(29-14-28-19)12-16(15)13-25-24-22(18-9-5-6-10-21(18)30-24)23(27)26-17-7-3-2-4-8-17/h11-13,17H,2-10,14H2,1H3,(H,26,27)/b25-13+
InChIKey YFDUYZFYLBOJKR-DHRITJCHSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8314
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: 9686704; UBI_ID: UBI-008317
Synonyms N-cyclohexyl-2-{[(6-methyl-1,3-benzodioxol-5-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Temperature 308 °C