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2-(benzo[d]thiazol-2-ylthio)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)butanamide
SpectraBase Compound ID 33o1mICQxqK
InChI InChI=1S/C22H22N4O2S2/c1-4-17(29-22-23-16-12-8-9-13-18(16)30-22)20(27)24-19-14(2)25(3)26(21(19)28)15-10-6-5-7-11-15/h5-13,17H,4H2,1-3H3,(H,24,27)
InChIKey GUWSONDZTFEOAA-UHFFFAOYSA-N
Mol Weight 438.56 g/mol
Molecular Formula C22H22N4O2S2
Exact Mass 438.118418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JS0HUu1X16k
Name 2-(benzo[d]thiazol-2-ylthio)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)butanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N4O2S2
InChI InChI=1S/C22H22N4O2S2/c1-4-17(29-22-23-16-12-8-9-13-18(16)30-22)20(27)24-19-14(2)25(3)26(21(19)28)15-10-6-5-7-11-15/h5-13,17H,4H2,1-3H3,(H,24,27)
InChIKey GUWSONDZTFEOAA-UHFFFAOYSA-N
Molecular Weight 438.564 g/mol
SMILES N(C1=C(N(N(C1=O)c1ccccc1)C)C)C(C(Sc1sc2ccccc2n1)CC)=O
SPLASH splash10-0a4i-9000000000-1dad5f82da2f4b1a8d83
Source of Spectrum Y1-43B-214-5g
Synonyms 2-(1,3-benzothiazol-2-ylthio)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)butanamide 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)butanamide 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)butanamide 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)butanamide
Wiley ID 1744252