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1-[5-(4-Chlorobenzylsulfanyl)-4-methyl-4H-[1,2,4]triazol-3-ylmethyl]-3-methoxy-1H-pyridin-2-one
SpectraBase Compound ID GvMfkxXdn0A
InChI InChI=1S/C17H17ClN4O2S/c1-21-15(10-22-9-3-4-14(24-2)16(22)23)19-20-17(21)25-11-12-5-7-13(18)8-6-12/h3-9H,10-11H2,1-2H3
InChIKey OLRYUXHMYARCOY-UHFFFAOYSA-N
Mol Weight 376.86 g/mol
Molecular Formula C17H17ClN4O2S
Exact Mass 376.076075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G8rz3oV1BOO
Name 1-[5-(4-Chlorobenzylsulfanyl)-4-methyl-4H-[1,2,4]triazol-3-ylmethyl]-3-methoxy-1H-pyridin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClN4O2S
InChI InChI=1S/C17H17ClN4O2S/c1-21-15(10-22-9-3-4-14(24-2)16(22)23)19-20-17(21)25-11-12-5-7-13(18)8-6-12/h3-9H,10-11H2,1-2H3
InChIKey OLRYUXHMYARCOY-UHFFFAOYSA-N
Molecular Weight 376.862 g/mol
SMILES COC=1C(N(Cc2[n](c(nn2)SCc2ccc(cc2)Cl)C)C=CC1)=O
SPLASH splash10-004i-7911000000-5a8dd9e02bc00266b8c6
Source of Spectrum AD-0-2532-0
Synonyms 1-((5-[(4-Chlorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl)methyl)-3-methoxy-2(1H)-pyridinone 1-[[5-[(4-chlorobenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl]-3-methoxy-2-pyridone 1-[[5-[(4-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-3-methoxy-pyridin-2-one 1-[[5-[(4-chlorophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]methyl]-3-methoxy-2-pyridinone
Wiley ID 1431378