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3-Cyano-7-hydroxy-N-(2-methoxyphenyl)-7-methyl-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-6-carboxamide
SpectraBase Compound ID JBOebdtINyC
InChI InChI=1S/C22H21N5O3/c1-22(29)18(21(28)25-16-10-6-7-11-17(16)30-2)19(14-8-4-3-5-9-14)26-20-15(12-23)13-24-27(20)22/h3-11,13,18-19,26,29H,1-2H3,(H,25,28)
InChIKey TVRKPYGXKUYMKK-UHFFFAOYSA-N
Mol Weight 403.44 g/mol
Molecular Formula C22H21N5O3
Exact Mass 403.16444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 429CQ7x3Z4b
Name 3-Cyano-7-hydroxy-N-(2-methoxyphenyl)-7-methyl-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-6-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21N5O3
InChI InChI=1S/C22H21N5O3/c1-22(29)18(21(28)25-16-10-6-7-11-17(16)30-2)19(14-8-4-3-5-9-14)26-20-15(12-23)13-24-27(20)22/h3-11,13,18-19,26,29H,1-2H3,(H,25,28)
InChIKey TVRKPYGXKUYMKK-UHFFFAOYSA-N
Molecular Weight 403.442 g/mol
SMILES N1C(C(C([n]2c1c(C#N)cn2)(O)C)C(Nc1c(OC)cccc1)=O)c1ccccc1
SPLASH splash10-00di-4900000000-599b9ae9f11a3ea93007
Source of Spectrum F-67-9396-6d
Wiley ID 1691219