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Benzenemethanamine, 4-(methylthio)-N-[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-
SpectraBase Compound ID 7TRHWfK1HtD
InChI InChI=1S/C18H17N5S2/c1-12-20-21-18-23(12)22-17(25-18)14-5-7-15(8-6-14)19-11-13-3-9-16(24-2)10-4-13/h3-10,19H,11H2,1-2H3
InChIKey PNXMGGCCHZJMCB-UHFFFAOYSA-N
Mol Weight 367.49 g/mol
Molecular Formula C18H17N5S2
Exact Mass 367.092538 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FRgYGrXgWkX
Name Benzenemethanamine, 4-(methylthio)-N-[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17N5S2
InChI InChI=1S/C18H17N5S2/c1-12-20-21-18-23(12)22-17(25-18)14-5-7-15(8-6-14)19-11-13-3-9-16(24-2)10-4-13/h3-10,19H,11H2,1-2H3
InChIKey PNXMGGCCHZJMCB-UHFFFAOYSA-N
Molecular Weight 367.489 g/mol
SMILES N(c1ccc(C2=N[n]3c(S2)nnc3C)cc1)Cc1ccc(SC)cc1
SPLASH splash10-000i-2901000000-b8453132d0d8b5628209
Synonyms N-[(4-methylsulfanylphenyl)methyl]-4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline N-[4-(methylsulfanyl)benzyl]-4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline N-[[4-(methylthio)phenyl]methyl]-4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline [4-(methylthio)benzyl]-[4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]amine
Wiley ID 1449227