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4-(N1-Cyclohexylidenethiocarbohydrazido)-3-pyrazolyl-5-chloro-1-phenylpyrazole

View entire compound with spectra: 2 MS (GC)

4-(N1-Cyclohexylidenethiocarbohydrazido)-3-pyrazolyl-5-chloro-1-phenylpyrazole
SpectraBase Compound ID CxylFk6Z3cK
InChI InChI=1S/C19H19ClN6S/c20-18-16(19(27)24-23-14-7-3-1-4-8-14)17(13-11-21-22-12-13)25-26(18)15-9-5-2-6-10-15/h2,5-6,9-12H,1,3-4,7-8H2,(H,21,22)(H,24,27)
InChIKey IEENAAJNSJGZHY-UHFFFAOYSA-N
Mol Weight 398.92 g/mol
Molecular Formula C19H19ClN6S
Exact Mass 398.108044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bGECbGxKWC
Name 5-Chloro-1-phenyl-1H,1'H-[3,4']bipyrazolyl-4-carbothioic acid cyclohexylidene-hydrazide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19ClN6S
InChI InChI=1S/C19H19ClN6S/c20-18-16(19(27)24-23-14-7-3-1-4-8-14)17(13-11-21-22-12-13)25-26(18)15-9-5-2-6-10-15/h2,5-6,9-12H,1,3-4,7-8H2,(H,21,22)(H,24,27)
InChIKey IEENAAJNSJGZHY-UHFFFAOYSA-N
Molecular Weight 398.916 g/mol
SMILES [nH]1ncc(-c2n[n](c(c2C(NN=C2CCCCC2)=S)Cl)-c2ccccc2)c1
SPLASH splash10-0002-3900000000-bcede44d9b3bbc79577b
Source of Spectrum QC-23-47-16
Synonyms 4-(N1-Cyclohexylidenethiocarbohydrazido)-3-pyrazolyl-5-chloro-1-phenylpyrazole 5-Chloro-N-(cyclohexylideneamino)-1-phenyl-3-(1H-pyrazol-4-yl)-1H-pyrazole-4-carbothioamide
Wiley ID 1583879