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cyclohexanecarboxamide, 4-[[(1,2-dihydro-2-thioxo-4-quinazolinyl)amino]methyl]-N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-

View entire compound with spectra: 1 NMR

cyclohexanecarboxamide, 4-[[(1,2-dihydro-2-thioxo-4-quinazolinyl)amino]methyl]-N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-
SpectraBase Compound ID CdsDYvujEDV
InChI InChI=1S/C30H40N6O2S/c1-38-25-13-11-24(12-14-25)36-19-17-35(18-20-36)16-4-15-31-29(37)23-9-7-22(8-10-23)21-32-28-26-5-2-3-6-27(26)33-30(39)34-28/h2-3,5-6,11-14,22-23H,4,7-10,15-21H2,1H3,(H,31,37)(H2,32,33,34,39)
InChIKey AWWUAWNKXYUOAA-UHFFFAOYSA-N
Mol Weight 548.8 g/mol
Molecular Formula C30H40N6O2S
Exact Mass 548.293346 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B1LLG46llAX
Name cyclohexanecarboxamide, 4-[[(1,2-dihydro-2-thioxo-4-quinazolinyl)amino]methyl]-N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]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/C30H40N6O2S/c1-38-25-13-11-24(12-14-25)36-19-17-35(18-20-36)16-4-15-31-29(37)23-9-7-22(8-10-23)21-32-28-26-5-2-3-6-27(26)33-30(39)34-28/h2-3,5-6,11-14,22-23H,4,7-10,15-21H2,1H3,(H,31,37)(H2,32,33,34,39)
InChIKey AWWUAWNKXYUOAA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6661
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/12219962