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2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone
SpectraBase Compound ID L3vouV7x6tn
InChI InChI=1S/C23H19N3OS2/c24-17-11-12-18-21(13-17)29-23(25-18)28-14-22(27)26-19-7-3-1-5-15(19)9-10-16-6-2-4-8-20(16)26/h1-8,11-13H,9-10,14,24H2
InChIKey KDQLOBGPHLWMBN-UHFFFAOYSA-N
Mol Weight 417.55 g/mol
Molecular Formula C23H19N3OS2
Exact Mass 417.096955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8VmUfWMTOwn
Name 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone
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Formula C23H19N3OS2
InChI InChI=1S/C23H19N3OS2/c24-17-11-12-18-21(13-17)29-23(25-18)28-14-22(27)26-19-7-3-1-5-15(19)9-10-16-6-2-4-8-20(16)26/h1-8,11-13H,9-10,14,24H2
InChIKey KDQLOBGPHLWMBN-UHFFFAOYSA-N
Molecular Weight 417.545 g/mol
SMILES Nc1cc2sc(SCC(N3c4c(CCc5c3cccc5)cccc4)=O)nc2cc1
SPLASH splash10-008d-2920000000-9c19bf8d523cbbc55e30
Synonyms 2-[(6-amino-1,3-benzothiazol-2-yl)thio]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone 2-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone 2-{[2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-amine
Wiley ID 1454574