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6-Benzyl-2,3-dihydro-1-[(4'-benzyl-1'-piperazinyl)carbonyl]-1H-thieno[2,3-b]-(1,4)-thiazine-1-carboxamide
SpectraBase Compound ID faY1MZe6W0
InChI InChI=1S/C25H27N3OS2/c29-25(27-13-11-26(12-14-27)19-21-9-5-2-6-10-21)28-15-16-30-24-23(28)18-22(31-24)17-20-7-3-1-4-8-20/h1-10,18H,11-17,19H2
InChIKey NGFNHJSPWRUWRR-UHFFFAOYSA-N
Mol Weight 449.63 g/mol
Molecular Formula C25H27N3OS2
Exact Mass 449.159555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CrzeT24WqZ
Name 6-Benzyl-2,3-dihydro-1-[(4'-benzyl-1'-piperazinyl)carbonyl]-1H-thieno[2,3-b]-(1,4)-thiazine-1-carboxamide
Comments Less than 3 mono-isotopic peaks
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Formula C25H27N3OS2
InChI InChI=1S/C25H27N3OS2/c29-25(27-13-11-26(12-14-27)19-21-9-5-2-6-10-21)28-15-16-30-24-23(28)18-22(31-24)17-20-7-3-1-4-8-20/h1-10,18H,11-17,19H2
InChIKey NGFNHJSPWRUWRR-UHFFFAOYSA-N
Molecular Weight 449.631 g/mol
SMILES c12N(C(N3CCN(CC3)Cc3ccccc3)=O)CCSc2sc(c1)Cc1ccccc1
SPLASH splash10-0006-9000400000-a0b41c7b0280a28a1256
Source of Spectrum D8-333-62-10
Synonyms 6-benzyl-1-[(4-benzyl-1-piperazinyl)carbonyl]-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazine
Wiley ID 1516738