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1-(2-cyanoethyl)-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-methyl-thiourea
SpectraBase Compound ID ArOWy367XkD
InChI InChI=1S/C16H19N5OS/c1-12-14(18-16(23)19(2)11-7-10-17)15(22)21(20(12)3)13-8-5-4-6-9-13/h4-6,8-9H,7,11H2,1-3H3,(H,18,23)
InChIKey KQEKMHNRAMXWJW-UHFFFAOYSA-N
Mol Weight 329.42 g/mol
Molecular Formula C16H19N5OS
Exact Mass 329.131031 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RHmwO6KEDo
Name 1-(2-cyanoethyl)-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-methyl-thiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19N5OS
InChI InChI=1S/C16H19N5OS/c1-12-14(18-16(23)19(2)11-7-10-17)15(22)21(20(12)3)13-8-5-4-6-9-13/h4-6,8-9H,7,11H2,1-3H3,(H,18,23)
InChIKey KQEKMHNRAMXWJW-UHFFFAOYSA-N
Molecular Weight 329.422 g/mol
SMILES N(C=1C(N(c2ccccc2)N(C1C)C)=O)C(=S)N(CCC#N)C
SPLASH splash10-052b-9360000000-e37c8c4fca358d07cdab
Synonyms 1-(2-cyanoethyl)-3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-methylthiourea 1-(2-cyanoethyl)-3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-methyl-thiourea 1-(2-cyanoethyl)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-1-methyl-thiourea
Wiley ID 1511727