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5-({[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-2-phenyl-2H-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID 4BQmouFd9SD
InChI InChI=1S/C14H14N8O2S/c1-21-8-16-18-14(21)25-7-10(23)17-13-11(12(15)24)19-22(20-13)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H2,15,24)(H,17,20,23)
InChIKey RDSMWZHPUOANKG-UHFFFAOYSA-N
Mol Weight 358.38 g/mol
Molecular Formula C14H14N8O2S
Exact Mass 358.096043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ADVnJo3Y6U1
Name 5-({[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N8O2S
InChI InChI=1S/C14H14N8O2S/c1-21-8-16-18-14(21)25-7-10(23)17-13-11(12(15)24)19-22(20-13)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H2,15,24)(H,17,20,23)
InChIKey RDSMWZHPUOANKG-UHFFFAOYSA-N
Molecular Weight 358.380 g/mol
SMILES NC(c1n[n](nc1NC(=O)CSc1[n](cnn1)C)-c1ccccc1)=O
SPLASH splash10-004i-9500000000-a575c6468fdf723470d8
Synonyms 5-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide 5-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-2-phenyl-triazole-4-carboxamide 5-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-2-phenyl-4-triazolecarboxamide 5-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-2-phenyl-triazole-4-carboxamide
Wiley ID 1453750