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N-[(2,5-diphenyl-2-pyrazolin-3-yl)methyl-keto-phenyl-persulfuranylidene]-4-methyl-benzenesulfonamide
SpectraBase Compound ID Cqs18ZYwA0X
InChI InChI=1S/C29H27N3O3S2/c1-23-17-19-28(20-18-23)37(34,35)31-36(33,27-15-9-4-10-16-27)22-26-21-29(24-11-5-2-6-12-24)30-32(26)25-13-7-3-8-14-25/h2-20,26H,21-22H2,1H3
InChIKey MCBSLBWXVWKKIA-UHFFFAOYSA-N
Mol Weight 529.67 g/mol
Molecular Formula C29H27N3O3S2
Exact Mass 529.149384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cetx8TchfRO
Name N-[(2,5-diphenyl-2-pyrazolin-3-yl)methyl-keto-phenyl-persulfuranylidene]-4-methyl-benzenesulfonamide
Alternate Name(s) N-[(2,5-diphenyl-3,4-dihydropyrazol-3-yl)methyl-oxo-phenyl-$l^{6}-sulfanylidene]-4-methylbenzenesulfonamide N-[(2,5-diphenyl-3,4-dihydropyrazol-3-yl)methyl-oxo-phenyl-$l^{6}-sulfanylidene]-4-methyl-benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H27N3O3S2
InChI InChI=1S/C29H27N3O3S2/c1-23-17-19-28(20-18-23)37(34,35)31-36(33,27-15-9-4-10-16-27)22-26-21-29(24-11-5-2-6-12-24)30-32(26)25-13-7-3-8-14-25/h2-20,26H,21-22H2,1H3
InChIKey MCBSLBWXVWKKIA-UHFFFAOYSA-N
Molecular Weight 529.673 g/mol
SMILES C(S(=NS(c1ccc(cc1)C)(=O)=O)(=O)c1ccccc1)C1N(N=C(C1)c1ccccc1)c1ccccc1
SPLASH splash10-00al-7190000000-fad09d8809a4bb417cdf
Source of Spectrum AJ-42-606-14
Wiley ID 1567934