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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KwbJSFDkfQi
Name 2-Chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(methylsulfanyl)benzamide
Alternate Name(s) 2-Chloranyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-methylsulfanyl-benzamide 2-Chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-5-(methylthio)benzamide 2-Chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-5-methylsulfanyl-benzamide 2-Chloro-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-5-(methylthio)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
SMILES N(C=1C(N(c2ccccc2)N(C1C)C)=O)C(c1c(ccc(c1)SC)Cl)=O
SPLASH splash10-0k9i-5922000000-0f510692cf19d50e0709
Wiley ID 1453304