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acetamide, 2-[(3,4,5,6,7,8-hexahydro-4-oxobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio]-N-[3-(1H-imidazol-1-yl)propyl]-
SpectraBase Compound ID 94GOAfxVS9a
InChI InChI=1S/C18H21N5O2S2/c24-14(20-6-3-8-23-9-7-19-11-23)10-26-18-21-16(25)15-12-4-1-2-5-13(12)27-17(15)22-18/h7,9,11H,1-6,8,10H2,(H,20,24)(H,21,22,25)
InChIKey FJQJPZNPHWIRPI-UHFFFAOYSA-N
Mol Weight 403.52 g/mol
Molecular Formula C18H21N5O2S2
Exact Mass 403.113667 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LXgqUtcA40C
Name acetamide, 2-[(3,4,5,6,7,8-hexahydro-4-oxobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio]-N-[3-(1H-imidazol-1-yl)propyl]-
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/C18H21N5O2S2/c24-14(20-6-3-8-23-9-7-19-11-23)10-26-18-21-16(25)15-12-4-1-2-5-13(12)27-17(15)22-18/h7,9,11H,1-6,8,10H2,(H,20,24)(H,21,22,25)
InChIKey FJQJPZNPHWIRPI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6328
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/10266469