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3-Methyl-2-(7-phenylhydrazono-6-methyl-7H-1,2,4-triazolo[3,4-b]-1,3,4-thiadiazin-3-yl)thiazolo[3,2-a]benzimidazole
SpectraBase Compound ID D8I7VhDrIzq
InChI InChI=1S/C21H16N8S2/c1-12-19(25-23-14-8-4-3-5-9-14)31-21-26-24-18(29(21)27-12)17-13(2)28-16-11-7-6-10-15(16)22-20(28)30-17/h3-11,23H,1-2H3
InChIKey QKIISSORBRYXPA-UHFFFAOYSA-N
Mol Weight 444.54 g/mol
Molecular Formula C21H16N8S2
Exact Mass 444.093935 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YSYSbCWXux
Name 3-Methyl-2-(7-phenylhydrazono-6-methyl-7H-1,2,4-triazolo[3,4-b]-1,3,4-thiadiazin-3-yl)thiazolo[3,2-a]benzimidazole
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Formula C21H16N8S2
InChI InChI=1S/C21H16N8S2/c1-12-19(25-23-14-8-4-3-5-9-14)31-21-26-24-18(29(21)27-12)17-13(2)28-16-11-7-6-10-15(16)22-20(28)30-17/h3-11,23H,1-2H3
InChIKey QKIISSORBRYXPA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200700222
Molecular Weight 444.535 g/mol
SMILES N(N=C1Sc2nnc(C3=C([n]4c5c(nc4S3)cccc5)C)[n]2N=C1C)c1ccccc1
SPLASH splash10-0002-3394300000-c1097eb270c2db745651
Source of Spectrum QA-54-1580-12a
Synonyms 3-Methyl-2-(6-methyl-7-(2-phenylhydrazineylidene)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl)benzo[4,5]imidazo[2,1-b]thiazole
Wiley ID 1796349