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Benzenesulfonamide, 4-[2,5-dihydro-2,3-dimethyl-4-(1-methylethyl)-5-oxo-1H-pyrazol-1-yl]-N-(9-oxo-9H-thioxanthen-2-yl)-
SpectraBase Compound ID HWQ5z0s3Cf6
InChI InChI=1S/C27H25N3O4S2/c1-16(2)25-17(3)29(4)30(27(25)32)19-10-12-20(13-11-19)36(33,34)28-18-9-14-24-22(15-18)26(31)21-7-5-6-8-23(21)35-24/h5-16,28H,1-4H3
InChIKey POMYGXPHRZNMND-UHFFFAOYSA-N
Mol Weight 519.63 g/mol
Molecular Formula C27H25N3O4S2
Exact Mass 519.128649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CN8G2BTBKwj
Name Benzenesulfonamide, 4-[2,5-dihydro-2,3-dimethyl-4-(1-methylethyl)-5-oxo-1H-pyrazol-1-yl]-N-(9-oxo-9H-thioxanthen-2-yl)-
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Formula C27H25N3O4S2
InChI InChI=1S/C27H25N3O4S2/c1-16(2)25-17(3)29(4)30(27(25)32)19-10-12-20(13-11-19)36(33,34)28-18-9-14-24-22(15-18)26(31)21-7-5-6-8-23(21)35-24/h5-16,28H,1-4H3
InChIKey POMYGXPHRZNMND-UHFFFAOYSA-N
Molecular Weight 519.634 g/mol
SMILES N(S(=O)(=O)c1ccc(cc1)N1C(C(=C(N1C)C)C(C)C)=O)c1ccc2Sc3c(cccc3)C(c2c1)=O
SPLASH splash10-0bvl-9420000000-6d776912efd15900fd1f
Source of Spectrum IY-1-4501-2
Synonyms 4-(2,3-dimethyl-5-oxo-4-propan-2-yl-1-pyrazolyl)-N-(9-oxo-2-thioxanthenyl)benzenesulfonamide 4-(2,3-dimethyl-5-oxo-4-propan-2-ylpyrazol-1-yl)-N-(9-oxothioxanthen-2-yl)benzenesulfonamide 4-(4-isopropyl-2,3-dimethyl-5-oxo-pyrazol-1-yl)-N-(9-oxothioxanthen-2-yl)benzenesulfonamide 4-(2,3-dimethyl-5-oxidanylidene-4-propan-2-yl-pyrazol-1-yl)-N-(9-oxidanylidenethioxanthen-2-yl)benzenesulfonamide
Wiley ID 1652995