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N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiourea
SpectraBase Compound ID D9KS6leltGk
InChI InChI=1S/C12H14N4OS/c1-8-10(14-12(13)18)11(17)16(15(8)2)9-6-4-3-5-7-9/h3-7H,1-2H3,(H3,13,14,18)
InChIKey NIXXJWATYYKOSW-UHFFFAOYSA-N
Mol Weight 262.33 g/mol
Molecular Formula C12H14N4OS
Exact Mass 262.088832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CkariWmboHj
Name N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiourea
CAS Registry Number 116432-95-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N4OS
InChI InChI=1S/C12H14N4OS/c1-8-10(14-12(13)18)11(17)16(15(8)2)9-6-4-3-5-7-9/h3-7H,1-2H3,(H3,13,14,18)
InChIKey NIXXJWATYYKOSW-UHFFFAOYSA-N
Molecular Weight 262.331 g/mol
SMILES N(C=1C(N(c2ccccc2)N(C1C)C)=O)C(=S)N
SPLASH splash10-0a4i-9110000000-9135b44d50d5530717d6
Source of Spectrum AD-0-2532-0
Synonyms (1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)thiourea (1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)thiourea (3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiourea 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)thiourea Pyrazol-3(2H)-one, 1,5-dimethyl-2-phenyl-4-thioureido-
Wiley ID 1424332