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[1,3]dioxolo[4,5-g]quinazoline-7-butanamide, N-[(2-chlorophenyl)methyl]-5,6,7,8-tetrahydro-8-oxo-6-thioxo-
SpectraBase Compound ID FGSteNIvpYy
InChI InChI=1S/C20H18ClN3O4S/c21-14-5-2-1-4-12(14)10-22-18(25)6-3-7-24-19(26)13-8-16-17(28-11-27-16)9-15(13)23-20(24)29/h1-2,4-5,8-9H,3,6-7,10-11H2,(H,22,25)(H,23,29)
InChIKey QDAZFIGBUHDKGY-UHFFFAOYSA-N
Mol Weight 431.89 g/mol
Molecular Formula C20H18ClN3O4S
Exact Mass 431.070655 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2dkMYeWyjOX
Name [1,3]dioxolo[4,5-g]quinazoline-7-butanamide, N-[(2-chlorophenyl)methyl]-5,6,7,8-tetrahydro-8-oxo-6-thioxo-
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/C20H18ClN3O4S/c21-14-5-2-1-4-12(14)10-22-18(25)6-3-7-24-19(26)13-8-16-17(28-11-27-16)9-15(13)23-20(24)29/h1-2,4-5,8-9H,3,6-7,10-11H2,(H,22,25)(H,23,29)
InChIKey QDAZFIGBUHDKGY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6612
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/11328972