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2-Bromo-N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
SpectraBase Compound ID CUjXkyTa3nY
InChI InChI=1S/C20H18BrN3O2S2/c1-12(21)19(26)22-14-6-7-15-17(10-14)28-20(23-15)27-11-18(25)24-9-8-13-4-2-3-5-16(13)24/h2-7,10,12H,8-9,11H2,1H3,(H,22,26)
InChIKey VXDOLOPCUIIKBL-UHFFFAOYSA-N
Mol Weight 476.41 g/mol
Molecular Formula C20H18BrN3O2S2
Exact Mass 475.002382 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YAg9LeLdkz
Name 2-Bromo-N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
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Formula C20H18BrN3O2S2
InChI InChI=1S/C20H18BrN3O2S2/c1-12(21)19(26)22-14-6-7-15-17(10-14)28-20(23-15)27-11-18(25)24-9-8-13-4-2-3-5-16(13)24/h2-7,10,12H,8-9,11H2,1H3,(H,22,26)
InChIKey VXDOLOPCUIIKBL-UHFFFAOYSA-N
Molecular Weight 476.407 g/mol
SMILES N(C(=O)C(Br)C)c1cc2sc(SCC(N3c4c(cccc4)CC3)=O)nc2cc1
SPLASH splash10-014i-5913000000-8e156946ce60cc5abace
Synonyms 2-Bromanyl-N-[2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide 2-Bromo-N-[2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-1,3-benzothiazol-6-yl]propanamide 2-Bromo-N-[2-[(2-indolin-1-yl-2-keto-ethyl)thio]-1,3-benzothiazol-6-yl]propionamide 2-Bromo-N-[2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide 2-Bromo-N-[2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]propanamide
Wiley ID 1447106