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2-[4-Ethyl-5-(4-methoxyphenyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-N-[4-(1-hydroxyiminoethyl)phenyl]acetamide
SpectraBase Compound ID 6AAKySkS2o9
InChI InChI=1S/C21H23N5O3S/c1-4-26-20(16-7-11-18(29-3)12-8-16)23-24-21(26)30-13-19(27)22-17-9-5-15(6-10-17)14(2)25-28/h5-12,28H,4,13H2,1-3H3,(H,22,27)/b25-14+
InChIKey SJAGJGPUITYQCD-AFUMVMLFSA-N
Mol Weight 425.51 g/mol
Molecular Formula C21H23N5O3S
Exact Mass 425.152161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5SlauiBJWVM
Name 2-[4-Ethyl-5-(4-methoxyphenyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-N-[4-(1-hydroxyiminoethyl)phenyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N5O3S
InChI InChI=1S/C21H23N5O3S/c1-4-26-20(16-7-11-18(29-3)12-8-16)23-24-21(26)30-13-19(27)22-17-9-5-15(6-10-17)14(2)25-28/h5-12,28H,4,13H2,1-3H3,(H,22,27)/b25-14+
InChIKey SJAGJGPUITYQCD-AFUMVMLFSA-N
Molecular Weight 425.507 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1ccc(cc1)OC)CC)=O)c1ccc(\C(=N\O)C)cc1
SPLASH splash10-0006-0129000000-674bb89a1552f6109242
Source of Spectrum EMC-71-195-7f
Synonyms (E)-2-((4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(1-(hydroxyimino)ethyl)phenyl)acetamide 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-[4-[(1E)-1-hydroxyiminoethyl]phenyl]acetamide 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-[(E)-N-hydroxy-C-methyl-carbonimidoyl]phenyl]acetamide 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]phenyl]ethanamide
Wiley ID 1738927