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3-(5-bromo-1-propanoyl-indolin-7-yl)sulfonyl-1-indolin-1-yl-propan-1-one
SpectraBase Compound ID 2AGrJaWTX4o
InChI InChI=1S/C22H23BrN2O4S/c1-2-20(26)25-11-8-16-13-17(23)14-19(22(16)25)30(28,29)12-9-21(27)24-10-7-15-5-3-4-6-18(15)24/h3-6,13-14H,2,7-12H2,1H3
InChIKey PJCYHHPDKRYKIN-UHFFFAOYSA-N
Mol Weight 491.4 g/mol
Molecular Formula C22H23BrN2O4S
Exact Mass 490.056191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgOYqZYMXYn
Name 3-(5-bromo-1-propanoyl-indolin-7-yl)sulfonyl-1-indolin-1-yl-propan-1-one
Alternate Name(s) 3-(5-bromo-1-propionyl-indolin-7-yl)sulfonyl-1-indolin-1-yl-propan-1-one 3-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-1-(2,3-dihydroindol-1-yl)propan-1-one 3-[(5-bromo-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-1-(2,3-dihydroindol-1-yl)propan-1-one 3-[[5-bromo-1-(1-oxopropyl)-2,3-dihydroindol-7-yl]sulfonyl]-1-(2,3-dihydroindol-1-yl)-1-propanone
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Formula C22H23BrN2O4S
InChI InChI=1S/C22H23BrN2O4S/c1-2-20(26)25-11-8-16-13-17(23)14-19(22(16)25)30(28,29)12-9-21(27)24-10-7-15-5-3-4-6-18(15)24/h3-6,13-14H,2,7-12H2,1H3
InChIKey PJCYHHPDKRYKIN-UHFFFAOYSA-N
Molecular Weight 491.400 g/mol
SMILES c1(S(CCC(N2c3c(cccc3)CC2)=O)(=O)=O)c2N(C(=O)CC)CCc2cc(c1)Br
SPLASH splash10-014i-6900000000-eabdc35180ce80599bd1
Wiley ID 1444994