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N-(3-chlorophenyl)-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylthio)propanamide
SpectraBase Compound ID DfBPmHzhO1S
InChI InChI=1S/C16H16ClN5OS/c1-9-7-10(2)22-15(18-9)20-16(21-22)24-11(3)14(23)19-13-6-4-5-12(17)8-13/h4-8,11H,1-3H3,(H,19,23)
InChIKey FWQSCHWLBJAQSV-UHFFFAOYSA-N
Mol Weight 361.85 g/mol
Molecular Formula C16H16ClN5OS
Exact Mass 361.076409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37k27PYU9Qu
Name N-(3-chlorophenyl)-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylthio)propanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16ClN5OS
InChI InChI=1S/C16H16ClN5OS/c1-9-7-10(2)22-15(18-9)20-16(21-22)24-11(3)14(23)19-13-6-4-5-12(17)8-13/h4-8,11H,1-3H3,(H,19,23)
InChIKey FWQSCHWLBJAQSV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hc.1075
Molecular Weight 361.851 g/mol
SMILES N(C(C(Sc1nc2N=C(C=C([n]2n1)C)C)C)=O)c1cccc(c1)Cl
SPLASH splash10-0aba-0960000000-ccfba68f831d87130385
Source of Spectrum HAC-12-494-3k
Synonyms N-(3-chlorophenyl)-2-((5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio)propanamide
Wiley ID 1783368