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Ethyl 7-amino-6-cyano-4,5-dihydro-2-methylthio-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxylate
SpectraBase Compound ID 4iajENfmJcj
InChI InChI=1S/C17H17N5O2S/c1-3-24-17(23)12-15-20-13(10-7-5-4-6-8-10)11(9-18)14(19)22(15)21-16(12)25-2/h4-8,13,20H,3,19H2,1-2H3
InChIKey ITJGMUKFGRUXHN-UHFFFAOYSA-N
Mol Weight 355.42 g/mol
Molecular Formula C17H17N5O2S
Exact Mass 355.110296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6SwDh32cOfS
Name Ethyl 7-amino-6-cyano-4,5-dihydro-2-methylthio-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17N5O2S
InChI InChI=1S/C17H17N5O2S/c1-3-24-17(23)12-15-20-13(10-7-5-4-6-8-10)11(9-18)14(19)22(15)21-16(12)25-2/h4-8,13,20H,3,19H2,1-2H3
InChIKey ITJGMUKFGRUXHN-UHFFFAOYSA-N
Molecular Weight 355.416 g/mol
SMILES N1C(C(=C([n]2c1c(c(n2)SC)C(=O)OCC)N)C#N)c1ccccc1
SPLASH splash10-001i-0092000000-576fe9235cd0430d189f
Source of Spectrum QA-48-95-11a
Synonyms Ethyl 7-amino-6-cyano-2-(methylthio)-5-phenyl-4,5-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate
Wiley ID 1795255