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3-[5-methoxy-2-(1-tosylindol-3-yl)pyrimidin-4-yl]-1-tosyl-indole
SpectraBase Compound ID 5DlrY47STHb
InChI InChI=1S/C35H28N4O5S2/c1-23-12-16-25(17-13-23)45(40,41)38-21-29(27-8-4-6-10-31(27)38)34-33(44-3)20-36-35(37-34)30-22-39(32-11-7-5-9-28(30)32)46(42,43)26-18-14-24(2)15-19-26/h4-22H,1-3H3
InChIKey UHNYWXZLLFQGPP-UHFFFAOYSA-N
Mol Weight 648.8 g/mol
Molecular Formula C35H28N4O5S2
Exact Mass 648.150112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7k1TZtNL2fK
Name 3-[5-methoxy-2-(1-tosylindol-3-yl)pyrimidin-4-yl]-1-tosyl-indole
Alternate Name(s) 3-[5-methoxy-2-[1-(4-methylphenyl)sulfonyl-3-indolyl]-4-pyrimidinyl]-1-(4-methylphenyl)sulfonylindole 3-[5-methoxy-2-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidin-4-yl]-1-(4-methylphenyl)sulfonyl-indole 3-[5-methoxy-2-[1-(p-tolylsulfonyl)indol-3-yl]pyrimidin-4-yl]-1-(p-tolylsulfonyl)indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H28N4O5S2
InChI InChI=1S/C35H28N4O5S2/c1-23-12-16-25(17-13-23)45(40,41)38-21-29(27-8-4-6-10-31(27)38)34-33(44-3)20-36-35(37-34)30-22-39(32-11-7-5-9-28(30)32)46(42,43)26-18-14-24(2)15-19-26/h4-22H,1-3H3
InChIKey UHNYWXZLLFQGPP-UHFFFAOYSA-N
Molecular Weight 648.752 g/mol
SMILES c1[n](S(c2ccc(cc2)C)(=O)=O)c2c(c1-c1nc(-c3c[n](S(c4ccc(cc4)C)(=O)=O)c4c3cccc4)c(cn1)OC)cccc2
SPLASH splash10-0007-3202409000-dd8c0516c951ebf6b4c0
Source of Spectrum H1-53-1495-7
Wiley ID 817927