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2-(4-Amino-5-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(4-phenoxy-phenyl)-acetamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-(4-Amino-5-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(4-phenoxy-phenyl)-acetamide
SpectraBase Compound ID KzuhbwBEQTJ
InChI InChI=1S/C17H17N5O2S/c1-12-20-21-17(22(12)18)25-11-16(23)19-13-7-9-15(10-8-13)24-14-5-3-2-4-6-14/h2-10H,11,18H2,1H3,(H,19,23)
InChIKey VATGKISWSSGLHI-UHFFFAOYSA-N
Mol Weight 355.42 g/mol
Molecular Formula C17H17N5O2S
Exact Mass 355.110296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6U1DIFpXw6
Name 2-(4-Amino-5-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(4-phenoxy-phenyl)-acetamide
Alternate Name(s) 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-N-(4-phenoxyphenyl)acetamide 2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenoxyphenyl)ethanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17N5O2S
InChI InChI=1S/C17H17N5O2S/c1-12-20-21-17(22(12)18)25-11-16(23)19-13-7-9-15(10-8-13)24-14-5-3-2-4-6-14/h2-10H,11,18H2,1H3,(H,19,23)
InChIKey VATGKISWSSGLHI-UHFFFAOYSA-N
Molecular Weight 355.416 g/mol
SMILES N(C(CSc1[n](c(nn1)C)N)=O)c1ccc(Oc2ccccc2)cc1
SPLASH splash10-00fr-1900000000-edf16e1692c79dcc640b
Wiley ID 1464600