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2-[1-(benzenesulfonyl)-3-(phenylthio)-2-indolyl]acetic acid methyl ester
SpectraBase Compound ID H8zSdMcHuAQ
InChI InChI=1S/C23H19NO4S2/c1-28-22(25)16-21-23(29-17-10-4-2-5-11-17)19-14-8-9-15-20(19)24(21)30(26,27)18-12-6-3-7-13-18/h2-15H,16H2,1H3
InChIKey QFLLIFKEFIKPCQ-UHFFFAOYSA-N
Mol Weight 437.53 g/mol
Molecular Formula C23H19NO4S2
Exact Mass 437.07555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjF2kwne6Ef
Name 2-[1-(benzenesulfonyl)-3-(phenylthio)-2-indolyl]acetic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H19NO4S2
InChI InChI=1S/C23H19NO4S2/c1-28-22(25)16-21-23(29-17-10-4-2-5-11-17)19-14-8-9-15-20(19)24(21)30(26,27)18-12-6-3-7-13-18/h2-15H,16H2,1H3
InChIKey QFLLIFKEFIKPCQ-UHFFFAOYSA-N
Molecular Weight 437.528 g/mol
SMILES c1(S([n]2c(c(Sc3ccccc3)c3c2cccc3)CC(=O)OC)(=O)=O)ccccc1
SPLASH splash10-000i-0093300000-9c96991d1a99b9bffdb9
Source of Spectrum Y1-46-4579-2
Synonyms 2-[1-besyl-3-(phenylthio)indol-2-yl]acetic acid methyl ester Methyl 2-[1-(benzenesulfonyl)-3-phenylsulfanyl-indol-2-yl]acetate Methyl 2-[3-phenylsulfanyl-1-(phenylsulfonyl)indol-2-yl]ethanoate
Wiley ID 1622548