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2-Methyl-5-[4-(4-methylanilino)-1-phthalazinyl]-N-(2-pyridinylmethyl)benzenesulfonamide
SpectraBase Compound ID JzdY2raSqgE
InChI InChI=1S/C28H25N5O2S/c1-19-10-14-22(15-11-19)31-28-25-9-4-3-8-24(25)27(32-33-28)21-13-12-20(2)26(17-21)36(34,35)30-18-23-7-5-6-16-29-23/h3-17,30H,18H2,1-2H3,(H,31,33)
InChIKey NMCJNSQIIPFBBU-UHFFFAOYSA-N
Mol Weight 495.6 g/mol
Molecular Formula C28H25N5O2S
Exact Mass 495.172896 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxM1pobm3c4
Name 2-Methyl-5-[4-(4-methylanilino)-1-phthalazinyl]-N-(2-pyridinylmethyl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H25N5O2S
InChI InChI=1S/C28H25N5O2S/c1-19-10-14-22(15-11-19)31-28-25-9-4-3-8-24(25)27(32-33-28)21-13-12-20(2)26(17-21)36(34,35)30-18-23-7-5-6-16-29-23/h3-17,30H,18H2,1-2H3,(H,31,33)
InChIKey NMCJNSQIIPFBBU-UHFFFAOYSA-N
Molecular Weight 495.601 g/mol
SMILES N(S(c1cc(-c2c3c(c(nn2)Nc2ccc(cc2)C)cccc3)ccc1C)(=O)=O)Cc1ncccc1
SPLASH splash10-00b9-9633100000-8d3cc1ff34eac4fbfb09
Synonyms 2-Methyl-5-[4-(4-methylanilino)phthalazin-1-yl]-N-(2-pyridylmethyl)benzenesulfonamide 2-Methyl-5-[4-(4-methylanilino)phthalazin-1-yl]-N-(pyridin-2-ylmethyl)benzenesulfonamide 2-Methyl-5-[4-(p-toluidino)phthalazin-1-yl]-N-(2-pyridylmethyl)benzenesulfonamide 2-Methyl-5-[4-[(4-methylphenyl)amino]phthalazin-1-yl]-N-(pyridin-2-ylmethyl)benzenesulfonamide
Wiley ID 1462767