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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-2-methyl-6-[[1-[(3-methylphenyl)methyl]-1H-indol-3-yl]methylene]-, (6Z)-
SpectraBase Compound ID 5Ln8lZ9QUds
InChI InChI=1S/C23H19N5OS/c1-14-6-5-7-16(10-14)12-27-13-17(18-8-3-4-9-20(18)27)11-19-21(24)28-23(25-22(19)29)30-15(2)26-28/h3-11,13,24H,12H2,1-2H3/b19-11-,24-21?
InChIKey ONOIEVBQTPOBHW-IBERAMNCSA-N
Mol Weight 413.5 g/mol
Molecular Formula C23H19N5OS
Exact Mass 413.131031 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 56oVzoR3sBQ
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-2-methyl-6-[[1-[(3-methylphenyl)methyl]-1H-indol-3-yl]methylene]-, (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/C23H19N5OS/c1-14-6-5-7-16(10-14)12-27-13-17(18-8-3-4-9-20(18)27)11-19-21(24)28-23(25-22(19)29)30-15(2)26-28/h3-11,13,24H,12H2,1-2H3/b19-11-,24-21?
InChIKey ONOIEVBQTPOBHW-IBERAMNCSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2555
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/11269226