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4-Chloranyl-5-[4-(4-methylsulfanylphenyl)sulfonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one
SpectraBase Compound ID 2uP5FuBAAVo
InChI InChI=1S/C21H21ClN4O3S2/c1-30-17-7-9-18(10-8-17)31(28,29)25-13-11-24(12-14-25)19-15-23-26(21(27)20(19)22)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3
InChIKey LCLDXPRBCPFQDU-UHFFFAOYSA-N
Mol Weight 477.0 g/mol
Molecular Formula C21H21ClN4O3S2
Exact Mass 476.074361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3h3be7yLTE
Name 4-Chloranyl-5-[4-(4-methylsulfanylphenyl)sulfonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one
Alternate Name(s) 4-Chloro-5-[4-(4-methylsulfanylphenyl)sulfonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one 4-Chloro-5-[4-[4-(methylthio)phenyl]sulfonyl-1-piperazinyl]-2-phenyl-3-pyridazinone 4-Chloro-5-[4-[4-(methylthio)phenyl]sulfonylpiperazino]-2-phenyl-pyridazin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21ClN4O3S2
InChI InChI=1S/C21H21ClN4O3S2/c1-30-17-7-9-18(10-8-17)31(28,29)25-13-11-24(12-14-25)19-15-23-26(21(27)20(19)22)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3
InChIKey LCLDXPRBCPFQDU-UHFFFAOYSA-N
Molecular Weight 476.997 g/mol
SMILES CSc1ccc(S(N2CCN(CC2)C2=C(C(N(N=C2)c2ccccc2)=O)Cl)(=O)=O)cc1
SPLASH splash10-0a70-9530000000-c49ea21ef42817608409
Wiley ID 1512458