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[6-bromanyl-5-methoxy-1-methyl-2-(phenylsulfanylmethyl)indol-3-yl]-(4-methylpiperazin-1-yl)methanone
SpectraBase Compound ID JhUzbtejseA
InChI InChI=1S/C23H26BrN3O2S/c1-25-9-11-27(12-10-25)23(28)22-17-13-21(29-3)18(24)14-19(17)26(2)20(22)15-30-16-7-5-4-6-8-16/h4-8,13-14H,9-12,15H2,1-3H3
InChIKey DYDZJJIFDLQOAX-UHFFFAOYSA-N
Mol Weight 488.44 g/mol
Molecular Formula C23H26BrN3O2S
Exact Mass 487.092911 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8iExVEh6XMg
Name [6-bromanyl-5-methoxy-1-methyl-2-(phenylsulfanylmethyl)indol-3-yl]-(4-methylpiperazin-1-yl)methanone
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Formula C23H26BrN3O2S
InChI InChI=1S/C23H26BrN3O2S/c1-25-9-11-27(12-10-25)23(28)22-17-13-21(29-3)18(24)14-19(17)26(2)20(22)15-30-16-7-5-4-6-8-16/h4-8,13-14H,9-12,15H2,1-3H3
InChIKey DYDZJJIFDLQOAX-UHFFFAOYSA-N
Molecular Weight 488.444 g/mol
SMILES c12cc(c(cc2c(c([n]1C)CSc1ccccc1)C(=O)N1CCN(CC1)C)OC)Br
SPLASH splash10-001r-9261000000-d0997beab55bd50c4988
Synonyms [6-bromo-5-methoxy-1-methyl-2-(phenylsulfanylmethyl)indol-3-yl]-(4-methylpiperazin-1-yl)methanone [6-bromo-5-methoxy-1-methyl-2-[(phenylthio)methyl]-3-indolyl]-(4-methyl-1-piperazinyl)methanone [6-bromo-5-methoxy-1-methyl-2-[(phenylthio)methyl]indol-3-yl]-(4-methylpiperazino)methanone
Wiley ID 1512192