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4-[( p-Bromobenzoyl)methylthio]-2-methylpyrimidino[4',5' : 4,5]thiazolo[3,2-a]benzimidazole
SpectraBase Compound ID 5ot29G5l3ya
InChI InChI=1S/C20H13BrN4OS2/c1-11-22-18(27-10-16(26)12-6-8-13(21)9-7-12)17-19(23-11)28-20-24-14-4-2-3-5-15(14)25(17)20/h2-9H,10H2,1H3
InChIKey KDEDDOHYXTUFDV-UHFFFAOYSA-N
Mol Weight 469.38 g/mol
Molecular Formula C20H13BrN4OS2
Exact Mass 467.971416 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERtdGIvLxTo
Name 4-[( p-Bromobenzoyl)methylthio]-2-methylpyrimidino[4',5' : 4,5]thiazolo[3,2-a]benzimidazole
Alternate Name(s) 1-(4-bromophenyl)-2-[(3-methylpyrimido[5',4':4,5][1,3]thiazolo[3,2-a]benzimidazol-1-yl)sulfanyl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H13BrN4OS2
InChI InChI=1S/C20H13BrN4OS2/c1-11-22-18(27-10-16(26)12-6-8-13(21)9-7-12)17-19(23-11)28-20-24-14-4-2-3-5-15(14)25(17)20/h2-9H,10H2,1H3
InChIKey KDEDDOHYXTUFDV-UHFFFAOYSA-N
Molecular Weight 469.375 g/mol
SMILES c12[n](-c3c(nc(nc3S2)C)SCC(c2ccc(cc2)Br)=O)c2ccccc2n1
SPLASH splash10-0cki-9410000000-561f8835286a2bb19287
Source of Spectrum AH-128-1139-11
Wiley ID 1392290