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2-(4-Allyl-5-pyridin-3-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(2-chloro-phenyl)-acetamide
SpectraBase Compound ID HuJKfzV7rVq
InChI InChI=1S/C18H16ClN5OS/c1-2-10-24-17(13-6-5-9-20-11-13)22-23-18(24)26-12-16(25)21-15-8-4-3-7-14(15)19/h2-9,11H,1,10,12H2,(H,21,25)
InChIKey JJXVOWXHQVWJKH-UHFFFAOYSA-N
Mol Weight 385.87 g/mol
Molecular Formula C18H16ClN5OS
Exact Mass 385.076409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0j62Up2FBw
Name 2-(4-Allyl-5-pyridin-3-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(2-chloro-phenyl)-acetamide
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Formula C18H16ClN5OS
InChI InChI=1S/C18H16ClN5OS/c1-2-10-24-17(13-6-5-9-20-11-13)22-23-18(24)26-12-16(25)21-15-8-4-3-7-14(15)19/h2-9,11H,1,10,12H2,(H,21,25)
InChIKey JJXVOWXHQVWJKH-UHFFFAOYSA-N
Molecular Weight 385.873 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1cnccc1)CC=C)=O)c1c(Cl)cccc1
SPLASH splash10-0a4u-8961000000-3fd8d8fb2ae4ccfd1ca5
Synonyms 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-chlorophenyl)acetamide 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(2-chlorophenyl)acetamide N-(2-chlorophenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(2-chlorophenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide N-(2-chlorophenyl)-2-[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide
Wiley ID 1466413