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2-(2,4-dimethylphenyl)sulfonyl-1-(1H-indol-3-yl)-1H-isoquinoline
SpectraBase Compound ID 2P2lTNNaOvh
InChI InChI=1S/C25H22N2O2S/c1-17-11-12-24(18(2)15-17)30(28,29)27-14-13-19-7-3-4-8-20(19)25(27)22-16-26-23-10-6-5-9-21(22)23/h3-16,25-26H,1-2H3
InChIKey OLLDLNACYLCABB-UHFFFAOYSA-N
Mol Weight 414.52 g/mol
Molecular Formula C25H22N2O2S
Exact Mass 414.140199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7naSgaDlixr
Name 2-(2,4-dimethylphenyl)sulfonyl-1-(1H-indol-3-yl)-1H-isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22N2O2S
InChI InChI=1S/C25H22N2O2S/c1-17-11-12-24(18(2)15-17)30(28,29)27-14-13-19-7-3-4-8-20(19)25(27)22-16-26-23-10-6-5-9-21(22)23/h3-16,25-26H,1-2H3
InChIKey OLLDLNACYLCABB-UHFFFAOYSA-N
Molecular Weight 414.523 g/mol
SMILES [nH]1c2c(c(c1)C1N(S(c3c(cc(cc3)C)C)(=O)=O)C=Cc3ccccc13)cccc2
SPLASH splash10-014l-8590000000-0405c1fafb0d36a9db1e
Synonyms 2-[(2,4-dimethylphenyl)sulfonyl]-1-(1H-indol-3-yl)-1,2-dihydroisoquinoline
Wiley ID 1448148