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acetamide, N-(3-chloro-4-fluorophenyl)-2-[[4-(2-propenyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID 7lZZAKG9msP
InChI InChI=1S/C18H15ClFN5OS/c1-2-8-25-17(12-4-3-7-21-10-12)23-24-18(25)27-11-16(26)22-13-5-6-15(20)14(19)9-13/h2-7,9-10H,1,8,11H2,(H,22,26)
InChIKey RZNZSBWPPGYPJM-UHFFFAOYSA-N
Mol Weight 403.86 g/mol
Molecular Formula C18H15ClFN5OS
Exact Mass 403.066987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fqx6JWy7u4
Name 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-chloro-4-fluoro-phenyl)acetamide
Alternate Name(s) 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(3-chloro-4-fluoro-phenyl)acetamide N-(3-chloranyl-4-fluoranyl-phenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide N-(3-chloro-4-fluorophenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(3-chloro-4-fluorophenyl)-2-[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide
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Formula C18H15ClFN5OS
InChI InChI=1S/C18H15ClFN5OS/c1-2-8-25-17(12-4-3-7-21-10-12)23-24-18(25)27-11-16(26)22-13-5-6-15(20)14(19)9-13/h2-7,9-10H,1,8,11H2,(H,22,26)
InChIKey RZNZSBWPPGYPJM-UHFFFAOYSA-N
Molecular Weight 403.863 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1cnccc1)CC=C)=O)c1cc(Cl)c(cc1)F
SPLASH splash10-0a4r-3940100000-cee145fd146c7cd5d40d
Wiley ID 1464286