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2-(5-[(1H-Benzimidazol-2-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl)-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID DF6aVDS0ljh
InChI InChI=1S/C18H11N5O2S2/c24-15-10-5-1-2-6-11(10)16(25)23(15)17-21-22-18(27-17)26-9-14-19-12-7-3-4-8-13(12)20-14/h1-8H,9H2,(H,19,20)
InChIKey QKWYYWDUWUGBMC-UHFFFAOYSA-N
Mol Weight 393.44 g/mol
Molecular Formula C18H11N5O2S2
Exact Mass 393.035417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1b2aRarmEj4
Name 2-(5-[(1H-Benzimidazol-2-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl)-1H-isoindole-1,3(2H)-dione
Alternate Name(s) 2-[5-(1H-benzimidazol-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]isoindole-1,3-dione 2-[5-(1H-benzimidazol-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]isoindoline-1,3-dione 2-[5-(1H-benzimidazol-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]isoindole-1,3-dione 2-[5-(1H-benzimidazol-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]isoindoline-1,3-quinone 2-[5-(1H-Benzoimidazol-2-ylmethylsulfanyl)-[1,3,4]thiadiazol-2-yl]-isoindole-1,3(2H)-dione
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Formula C18H11N5O2S2
InChI InChI=1S/C18H11N5O2S2/c24-15-10-5-1-2-6-11(10)16(25)23(15)17-21-22-18(27-17)26-9-14-19-12-7-3-4-8-13(12)20-14/h1-8H,9H2,(H,19,20)
InChIKey QKWYYWDUWUGBMC-UHFFFAOYSA-N
Molecular Weight 393.439 g/mol
SMILES [nH]1c2ccccc2nc1CSc1sc(N2C(c3ccccc3C2=O)=O)nn1
SPLASH splash10-0fai-5900000000-5f53497a76fd6b1b8e25
Wiley ID 1436847