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2-Imino-5-trifluoromethoxy1-[S-[methyl(tosyl)imino]thioethyl]benzothiazole
SpectraBase Compound ID DO3JysVDD7w
InChI InChI=1S/C18H18F3N3O3S3/c1-12-3-6-14(7-4-12)30(25,26)23-29(2)10-9-24-15-8-5-13(27-18(19,20)21)11-16(15)28-17(24)22/h3-8,11,22H,9-10H2,1-2H3
InChIKey BLLADHVABYSKTD-UHFFFAOYSA-N
Mol Weight 477.54 g/mol
Molecular Formula C18H18F3N3O3S3
Exact Mass 477.046239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWSmB0a8wIq
Name 2-Imino-5-trifluoromethoxy1-[S-[methyl(tosyl)imino]thioethyl]benzothiazole
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Formula C18H18F3N3O3S3
InChI InChI=1S/C18H18F3N3O3S3/c1-12-3-6-14(7-4-12)30(25,26)23-29(2)10-9-24-15-8-5-13(27-18(19,20)21)11-16(15)28-17(24)22/h3-8,11,22H,9-10H2,1-2H3
InChIKey BLLADHVABYSKTD-UHFFFAOYSA-N
Molecular Weight 477.535 g/mol
SMILES N=C1N(CCS(=NS(c2ccc(cc2)C)(=O)=O)C)c2c(cc(OC(F)(F)F)cc2)S1
SPLASH splash10-0a4l-5090000000-dcc63e167c82891808fc
Source of Spectrum H1-36-2749-9
Synonyms 2-Imino-5-trifluoromethoxy1-[S-(2-methyl-2-tosylimino)ethylthio]benzothiazole N-[(E)-[2-(2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3(2H)-yl)ethyl](methyl)-lambda(4)-sulfanylidene]-4-methylbenzenesulfonamide
Wiley ID 755666