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2-Amino-5-({3-[(4-chlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}-methyl)-1,3-thiazol-4-ol
SpectraBase Compound ID GU4NEWg0Vyr
InChI InChI=1S/C14H11ClN6O2S2/c15-7-1-3-8(4-2-7)23-6-10-18-19-14-21(10)20-11(25-14)5-9-12(22)17-13(16)24-9/h1-4,22H,5-6H2,(H2,16,17)
InChIKey IZMRGDJABMFQQG-UHFFFAOYSA-N
Mol Weight 394.86 g/mol
Molecular Formula C14H11ClN6O2S2
Exact Mass 394.007344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrioStePgCO
Name 2-Amino-5-({3-[(4-chlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}-methyl)-1,3-thiazol-4-ol
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Formula C14H11ClN6O2S2
InChI InChI=1S/C14H11ClN6O2S2/c15-7-1-3-8(4-2-7)23-6-10-18-19-14-21(10)20-11(25-14)5-9-12(22)17-13(16)24-9/h1-4,22H,5-6H2,(H2,16,17)
InChIKey IZMRGDJABMFQQG-UHFFFAOYSA-N
Molecular Weight 394.855 g/mol
SMILES Oc1c(sc(n1)N)CC1=N[n]2c(S1)nnc2COc1ccc(cc1)Cl
SPLASH splash10-0002-9140000000-51e9b5caa203a4fbbcf2
Source of Spectrum F2-44-2779-4c
Synonyms 2-Amino-5-[[3-[(4-chlorophenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl]-4-thiazolol 2-Amino-5-[[3-[(4-chlorophenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl]-1,3-thiazol-4-ol 2-Azanyl-5-[[3-[(4-chloranylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl]-1,3-thiazol-4-ol
Wiley ID 1716145