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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[5-(3-chloro-4-methylphenyl)-2-furanyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, (6Z)-
SpectraBase Compound ID Go2IV3sVbXn
InChI InChI=1S/C20H17ClN4O2S/c1-10(2)19-24-25-17(22)14(18(26)23-20(25)28-19)9-13-6-7-16(27-13)12-5-4-11(3)15(21)8-12/h4-10,22H,1-3H3/b14-9-,22-17?
InChIKey DZVZZSQTMUJWEX-UJADIJFVSA-N
Mol Weight 412.9 g/mol
Molecular Formula C20H17ClN4O2S
Exact Mass 412.076075 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EW62FgTGYsr
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[5-(3-chloro-4-methylphenyl)-2-furanyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, (6Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.076074675 u
Formula C20H17ClN4O2S
InChI InChI=1S/C20H17ClN4O2S/c1-10(2)19-24-25-17(22)14(18(26)23-20(25)28-19)9-13-6-7-16(27-13)12-5-4-11(3)15(21)8-12/h4-10,22H,1-3H3/b14-9-,22-17?
InChIKey DZVZZSQTMUJWEX-UJADIJFVSA-N
Molecular Weight 412.895 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12656
Solvent DMSO-d6
Source Vendor ID: ZI/10030308; Lab Info: CEP; Lab Number: CEP-6700136