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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[5-(2-methyl-4-nitrophenyl)-2-furanyl]methylene]-2-propyl-, (6Z)-
SpectraBase Compound ID 2gpLdWnUXC7
InChI InChI=1S/C20H17N5O4S/c1-3-4-17-23-24-18(21)15(19(26)22-20(24)30-17)10-13-6-8-16(29-13)14-7-5-12(25(27)28)9-11(14)2/h5-10,21H,3-4H2,1-2H3/b15-10-,21-18?
InChIKey GCXQKWNPBXYZSS-AHSZANDNSA-N
Mol Weight 423.45 g/mol
Molecular Formula C20H17N5O4S
Exact Mass 423.100125 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A251UF2hojG
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[5-(2-methyl-4-nitrophenyl)-2-furanyl]methylene]-2-propyl-, (6Z)-
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/C20H17N5O4S/c1-3-4-17-23-24-18(21)15(19(26)22-20(24)30-17)10-13-6-8-16(29-13)14-7-5-12(25(27)28)9-11(14)2/h5-10,21H,3-4H2,1-2H3/b15-10-,21-18?
InChIKey GCXQKWNPBXYZSS-AHSZANDNSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2965
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: ZI/10034350; Labnumber: CEP-6700172