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1,2,5-Oxadiazole-3-carboxamide, 4-amino-N-[2-[[[4-(methylthio)phenyl]methyl]amino]ethyl]-
SpectraBase Compound ID 3cw02ga7gce
InChI InChI=1S/C13H17N5O2S/c1-21-10-4-2-9(3-5-10)8-15-6-7-16-13(19)11-12(14)18-20-17-11/h2-5,15H,6-8H2,1H3,(H2,14,18)(H,16,19)
InChIKey FWVSRXXBDPSWEG-UHFFFAOYSA-N
Mol Weight 307.37 g/mol
Molecular Formula C13H17N5O2S
Exact Mass 307.110296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID p56BPUa9jK
Name 1,2,5-Oxadiazole-3-carboxamide, 4-amino-N-[2-[[[4-(methylthio)phenyl]methyl]amino]ethyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N5O2S
InChI InChI=1S/C13H17N5O2S/c1-21-10-4-2-9(3-5-10)8-15-6-7-16-13(19)11-12(14)18-20-17-11/h2-5,15H,6-8H2,1H3,(H2,14,18)(H,16,19)
InChIKey FWVSRXXBDPSWEG-UHFFFAOYSA-N
Molecular Weight 307.372 g/mol
SMILES Nc1c(C(=O)NCCNCc2ccc(SC)cc2)non1
SPLASH splash10-000i-2900000000-7a61c763a99c68be29c1
Synonyms 4-Amino-N-(2-{[4-(methylsulfanyl)benzyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide 4-Amino-N-[2-[(4-methylsulfanylphenyl)methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide 4-Amino-N-[2-[[4-(methylthio)benzyl]amino]ethyl]furazan-3-carboxamide 4-Amino-N-[2-[[4-(methylthio)phenyl]methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide 4-Azanyl-N-[2-[(4-methylsulfanylphenyl)methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide
Wiley ID 1448893