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N''-{6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-oxo-1,4-dihydro-2-pyrimidinyl}-N-(4-phenoxyphenyl)guanidine
SpectraBase Compound ID GGtC8vf5Wtc
InChI InChI=1S/C25H20N6O2S2/c26-23(27-16-10-12-19(13-11-16)33-18-6-2-1-3-7-18)31-24-28-17(14-22(32)30-24)15-34-25-29-20-8-4-5-9-21(20)35-25/h1-14H,15H2,(H4,26,27,28,30,31,32)
InChIKey HBBRVXZGTBLMBO-UHFFFAOYSA-N
Mol Weight 500.6 g/mol
Molecular Formula C25H20N6O2S2
Exact Mass 500.108916 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8JW03EqIXi8
Name N''-{6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-oxo-1,4-dihydro-2-pyrimidinyl}-N-(4-phenoxyphenyl)guanidine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 500.108916254 u
Formula C25H20N6O2S2
InChI InChI=1S/C25H20N6O2S2/c26-23(27-16-10-12-19(13-11-16)33-18-6-2-1-3-7-18)31-24-28-17(14-22(32)30-24)15-34-25-29-20-8-4-5-9-21(20)35-25/h1-14H,15H2,(H4,26,27,28,30,31,32)
InChIKey HBBRVXZGTBLMBO-UHFFFAOYSA-N
Molecular Weight 500.595 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_279
Solvent DMSO-d6
Source Vendor ID: NMR/12259976