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2-Chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(methylsulfanyl)benzamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-Chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(methylsulfanyl)benzamide
SpectraBase Compound ID 3MHpdodcuK
InChI InChI=1S/C19H18ClN3O2S/c1-12-17(19(25)23(22(12)2)13-7-5-4-6-8-13)21-18(24)15-11-14(26-3)9-10-16(15)20/h4-11H,1-3H3,(H,21,24)
InChIKey BXWDZVNHNWDIEF-UHFFFAOYSA-N
Mol Weight 387.89 g/mol
Molecular Formula C19H18ClN3O2S
Exact Mass 387.080826 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 78BbIMCzujE
Name benzamide, 2-chloro-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-(methylthio)-
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 387.080825704 u
Formula C19H18ClN3O2S
InChI InChI=1S/C19H18ClN3O2S/c1-12-17(19(25)23(22(12)2)13-7-5-4-6-8-13)21-18(24)15-11-14(26-3)9-10-16(15)20/h4-11H,1-3H3,(H,21,24)
InChIKey BXWDZVNHNWDIEF-UHFFFAOYSA-N
Molecular Weight 387.885 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14516
Solvent DMSO-d6
Source Vendor ID: NMR/10300504; Lab Info: LP; Lab Number: LP-2251111