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5-[(5-isopropyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanylmethyl]-2,1,3-benzoxadiazole
SpectraBase Compound ID ClAicNE7qro
InChI InChI=1S/C19H16N6OS/c1-11(2)25-16-6-4-3-5-13(16)17-18(25)20-19(22-21-17)27-10-12-7-8-14-15(9-12)24-26-23-14/h3-9,11H,10H2,1-2H3
InChIKey QZUAHPHJAARMBE-UHFFFAOYSA-N
Mol Weight 376.44 g/mol
Molecular Formula C19H16N6OS
Exact Mass 376.11063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6BJRizj7GJS
Name 5-[(5-isopropyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanylmethyl]-2,1,3-benzoxadiazole
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Formula C19H16N6OS
InChI InChI=1S/C19H16N6OS/c1-11(2)25-16-6-4-3-5-13(16)17-18(25)20-19(22-21-17)27-10-12-7-8-14-15(9-12)24-26-23-14/h3-9,11H,10H2,1-2H3
InChIKey QZUAHPHJAARMBE-UHFFFAOYSA-N
Molecular Weight 376.438 g/mol
SMILES c12c(c3ccccc3[n]2C(C)C)nnc(n1)SCc1cc2nonc2cc1
SPLASH splash10-0096-4913000000-a4601231ea8b4833b9fa
Synonyms 5-[(5-propan-2-yl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanylmethyl]-2,1,3-benzoxadiazole 5-[[(5-isopropyl-[1,2,4]triazin[5,6-b]indol-3-yl)thio]methyl]benzofurazan 5-[[(5-propan-2-yl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]methyl]-2,1,3-benzoxadiazole
Wiley ID 1442267