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2-[(4-chloro-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]-N-(2-methoxyphenyl)hydrazinecarbothioamide

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2-[(4-chloro-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]-N-(2-methoxyphenyl)hydrazinecarbothioamide
SpectraBase Compound ID 5CGH76NKEhI
InChI InChI=1S/C14H16ClN5O2S/c1-8-11(15)12(20(2)19-8)13(21)17-18-14(23)16-9-6-4-5-7-10(9)22-3/h4-7H,1-3H3,(H,17,21)(H2,16,18,23)
InChIKey HKJMSUBZFRZPAG-UHFFFAOYSA-N
Mol Weight 353.83 g/mol
Molecular Formula C14H16ClN5O2S
Exact Mass 353.071324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6JYZAEOjyJP
Name 2-[(4-Chloro-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]-N-(2-methoxyphenyl)hydrazinecarbothioamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.071323647 u
Formula C14H16ClN5O2S
InChI InChI=1S/C14H16ClN5O2S/c1-8-11(15)12(20(2)19-8)13(21)17-18-14(23)16-9-6-4-5-7-10(9)22-3/h4-7H,1-3H3,(H,17,21)(H2,16,18,23)
InChIKey HKJMSUBZFRZPAG-UHFFFAOYSA-N
Molecular Weight 353.828 g/mol
SMILES N(C(C=1N(N=C(C1Cl)C)C)=O)NC(NC=1C(OC)=CC=CC1)=S