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3-Phenyl-2-([1,2,4]triazolo[1,5-c]quinazoline-2-ylthio)propionic Acid Ethyl Ester
SpectraBase Compound ID II5iDAIhvRN
InChI InChI=1S/C20H18N4O2S/c1-2-26-19(25)17(12-14-8-4-3-5-9-14)27-20-22-18-15-10-6-7-11-16(15)21-13-24(18)23-20/h3-11,13,17H,2,12H2,1H3
InChIKey CFUIXMXTTJIBKG-UHFFFAOYSA-N
Mol Weight 378.45 g/mol
Molecular Formula C20H18N4O2S
Exact Mass 378.115047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TgGnHkEuLo
Name 3-Phenyl-2-([1,2,4]triazolo[1,5-c]quinazoline-2-ylthio)propionic Acid Ethyl Ester
Alternate Name(s) 3-Phenyl-2-([1,2,4]triazolo[1,5-c]quinazolin-2-ylthio)propanoic acid ethyl ester Ethyl 3-phenyl-2-([1,2,4]triazolo[1,5-c]quinazolin-2-ylsulfanyl)propanoate
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Formula C20H18N4O2S
InChI InChI=1S/C20H18N4O2S/c1-2-26-19(25)17(12-14-8-4-3-5-9-14)27-20-22-18-15-10-6-7-11-16(15)21-13-24(18)23-20/h3-11,13,17H,2,12H2,1H3
InChIKey CFUIXMXTTJIBKG-UHFFFAOYSA-N
Molecular Weight 378.450 g/mol
SMILES c-12[n](nc(n2)SC(C(=O)OCC)Cc2ccccc2)C=Nc2c1cccc2
SPLASH splash10-0udi-0190000000-152f888785d537a30bb7
Source of Spectrum E1-57-581-3g
Wiley ID 1661791