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N-(2-{2-[(Z)-(1-cyclopropyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-3-yl}ethyl)acetamide
SpectraBase Compound ID 5czFRObwsZi
InChI InChI=1S/C20H20N4O3S/c1-11(25)21-9-8-14-13-4-2-3-5-16(13)22-17(14)10-15-18(26)23-20(28)24(19(15)27)12-6-7-12/h2-5,10,12,22H,6-9H2,1H3,(H,21,25)(H,23,26,28)/b15-10-
InChIKey XZUKRLKANRJPJW-GDNBJRDFSA-N
Mol Weight 396.47 g/mol
Molecular Formula C20H20N4O3S
Exact Mass 396.125612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9Dj2YHKwYzP
Name N-(2-{2-[(Z)-(1-cyclopropyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-3-yl}ethyl)acetamide
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/C20H20N4O3S/c1-11(25)21-9-8-14-13-4-2-3-5-16(13)22-17(14)10-15-18(26)23-20(28)24(19(15)27)12-6-7-12/h2-5,10,12,22H,6-9H2,1H3,(H,21,25)(H,23,26,28)/b15-10-
InChIKey XZUKRLKANRJPJW-GDNBJRDFSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23408
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: D40314; Labnumber: NC98SP32-1507; SBI_ID: SBI-023412
Synonyms N-(2-{2-[(1-cyclopropyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-3-yl}ethyl)acetamide
Temperature 308 °C