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N-(3-chloro-2-methylphenyl)-N'-(6-methyl-4-oxo-1,4-dihydro-2-pyrimidinyl)-N''-[(Z)-oxo(phenyl)methyl]guanidine
SpectraBase Compound ID GIoy4rFFvHO
InChI InChI=1S/C20H18ClN5O2/c1-12-11-17(27)24-19(22-12)26-20(23-16-10-6-9-15(21)13(16)2)25-18(28)14-7-4-3-5-8-14/h3-11H,1-2H3,(H3,22,23,24,25,26,27,28)
InChIKey LLINZWAQGSLOCL-UHFFFAOYSA-N
Mol Weight 395.85 g/mol
Molecular Formula C20H18ClN5O2
Exact Mass 395.114903 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KQZ9F72Jgec
Name N-(3-chloro-2-methylphenyl)-N'-(6-methyl-4-oxo-1,4-dihydro-2-pyrimidinyl)-N''-[(Z)-oxo(phenyl)methyl]guanidine
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/C20H18ClN5O2/c1-12-11-17(27)24-19(22-12)26-20(23-16-10-6-9-15(21)13(16)2)25-18(28)14-7-4-3-5-8-14/h3-11H,1-2H3,(H3,22,23,24,25,26,27,28)
InChIKey LLINZWAQGSLOCL-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3167
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: D09128; Labnumber: VGU-18203; SBI_ID: SBI-003169
Synonyms N-(3-chloro-2-methylphenyl)-N'-(6-methyl-4-oxo-1,4-dihydro-2-pyrimidinyl)-N''-[oxo(phenyl)methyl]guanidine
Temperature 315 °C