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Ethyl 5-(methylthio)-2-(2,6-dichlorophenyl)[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
SpectraBase Compound ID fsUxqZ2msW
InChI InChI=1S/C15H12Cl2N4O2S/c1-3-23-14(22)8-7-18-15(24-2)21-13(8)19-12(20-21)11-9(16)5-4-6-10(11)17/h4-7H,3H2,1-2H3
InChIKey NWYHZZBBVDWBQO-UHFFFAOYSA-N
Mol Weight 383.25 g/mol
Molecular Formula C15H12Cl2N4O2S
Exact Mass 382.005802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LbJu0sn6HcA
Name Ethyl 5-(methylthio)-2-(2,6-dichlorophenyl)[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
CAS Registry Number 78514-99-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12Cl2N4O2S
InChI InChI=1S/C15H12Cl2N4O2S/c1-3-23-14(22)8-7-18-15(24-2)21-13(8)19-12(20-21)11-9(16)5-4-6-10(11)17/h4-7H,3H2,1-2H3
InChIKey NWYHZZBBVDWBQO-UHFFFAOYSA-N
Molecular Weight 383.253 g/mol
SMILES c12[n](nc(n2)-c2c(Cl)cccc2Cl)C(=NC=C1C(=O)OCC)SC
SPLASH splash10-01q9-0009000000-a2061f6f62fc1f88c204
Source of Spectrum J-46-3959-0
Synonyms Ethyl 2-(2,6-dichlorophenyl)-5-(methylsulfanyl)[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Wiley ID 1360359