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(6Z)-2-(1-ethylpropyl)-5-imino-6-[(2-methyl-1H-indol-3-yl)methylene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID J0AnG0Bm6yZ
InChI InChI=1S/C20H21N5OS/c1-4-12(5-2)19-24-25-17(21)15(18(26)23-20(25)27-19)10-14-11(3)22-16-9-7-6-8-13(14)16/h6-10,12,21-22H,4-5H2,1-3H3/b15-10-,21-17?
InChIKey RKNUHQSHORJKPG-SRRKIXIOSA-N
Mol Weight 379.48 g/mol
Molecular Formula C20H21N5OS
Exact Mass 379.146681 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lel501y84ji
Name (6Z)-2-(1-ethylpropyl)-5-imino-6-[(2-methyl-1H-indol-3-yl)methylene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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/C20H21N5OS/c1-4-12(5-2)19-24-25-17(21)15(18(26)23-20(25)27-19)10-14-11(3)22-16-9-7-6-8-13(14)16/h6-10,12,21-22H,4-5H2,1-3H3/b15-10-,21-17?
InChIKey RKNUHQSHORJKPG-SRRKIXIOSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25871
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: D61691; Labnumber: CEP4-3766; SBI_ID: SBI-025875
Synonyms 2-(1-ethylpropyl)-5-imino-6-[(2-methyl-1H-indol-3-yl)methylene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 318 °C