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benzamide, 4-[(hexahydro-1H-azepin-1-yl)sulfonyl]-N-[4-(2-pyridinyl)-2-thiazolyl]-
SpectraBase Compound ID FEBIBgkcyQA
InChI InChI=1S/C21H22N4O3S2/c26-20(24-21-23-19(15-29-21)18-7-3-4-12-22-18)16-8-10-17(11-9-16)30(27,28)25-13-5-1-2-6-14-25/h3-4,7-12,15H,1-2,5-6,13-14H2,(H,23,24,26)
InChIKey UXMVMRXIGDREGT-UHFFFAOYSA-N
Mol Weight 442.55 g/mol
Molecular Formula C21H22N4O3S2
Exact Mass 442.113333 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5au1yEq1t5B
Name benzamide, 4-[(hexahydro-1H-azepin-1-yl)sulfonyl]-N-[4-(2-pyridinyl)-2-thiazolyl]-
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/C21H22N4O3S2/c26-20(24-21-23-19(15-29-21)18-7-3-4-12-22-18)16-8-10-17(11-9-16)30(27,28)25-13-5-1-2-6-14-25/h3-4,7-12,15H,1-2,5-6,13-14H2,(H,23,24,26)
InChIKey UXMVMRXIGDREGT-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5624
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: NMR/10257346; Labnumber: F0700-0020