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1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone

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1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone
SpectraBase Compound ID 5Fb7cQoD4WZ
InChI InChI=1S/C19H16N4OS2/c24-17(22-10-9-13-5-1-2-6-14(13)11-22)12-25-18-20-21-19-23(18)15-7-3-4-8-16(15)26-19/h1-8H,9-12H2
InChIKey WEFRDFPERYLEDX-UHFFFAOYSA-N
Mol Weight 380.48 g/mol
Molecular Formula C19H16N4OS2
Exact Mass 380.076553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Euuk7AjCnX
Name 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone
Alternate Name(s) 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylthio)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N4OS2
InChI InChI=1S/C19H16N4OS2/c24-17(22-10-9-13-5-1-2-6-14(13)11-22)12-25-18-20-21-19-23(18)15-7-3-4-8-16(15)26-19/h1-8H,9-12H2
InChIKey WEFRDFPERYLEDX-UHFFFAOYSA-N
Molecular Weight 380.484 g/mol
SMILES c1cc2CCN(C(CSc3[n]-4c(nn3)Sc3c4cccc3)=O)Cc2cc1
SPLASH splash10-008a-3900000000-7d5664d58ca3fa189c3c
Wiley ID 1443963