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benzenesulfonamide, 5-[4-[(2,4-dimethylphenyl)amino]-1-phthalazinyl]-2-methyl-N-(2-pyridinylmethyl)-
SpectraBase Compound ID DDM76J8mX2T
InChI InChI=1S/C29H27N5O2S/c1-19-11-14-26(21(3)16-19)32-29-25-10-5-4-9-24(25)28(33-34-29)22-13-12-20(2)27(17-22)37(35,36)31-18-23-8-6-7-15-30-23/h4-17,31H,18H2,1-3H3,(H,32,34)
InChIKey KSWGBCSLUFEFCU-UHFFFAOYSA-N
Mol Weight 509.63 g/mol
Molecular Formula C29H27N5O2S
Exact Mass 509.188546 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56IqlArsLbD
Name 5-[4-(2,4-dimethylanilino)-1-phthalazinyl]-2-methyl-N-(2-pyridinylmethyl)benzenesulfonamide
Alternate Name(s) 5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-N-(2-pyridylmethyl)benzenesulfonamide 5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
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Formula C29H27N5O2S
InChI InChI=1S/C29H27N5O2S/c1-19-11-14-26(21(3)16-19)32-29-25-10-5-4-9-24(25)28(33-34-29)22-13-12-20(2)27(17-22)37(35,36)31-18-23-8-6-7-15-30-23/h4-17,31H,18H2,1-3H3,(H,32,34)
InChIKey KSWGBCSLUFEFCU-UHFFFAOYSA-N
Molecular Weight 509.628 g/mol
SMILES N(S(c1cc(-c2c3c(c(nn2)Nc2c(cc(cc2)C)C)cccc3)ccc1C)(=O)=O)Cc1ncccc1
SPLASH splash10-0a6r-8968230000-900ca8b7461f3a4e9164
Wiley ID 1462768