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2-(4-amino-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-6(7H)-ylidene)-N-benzyl-3-oxopropanamide
SpectraBase Compound ID 9y3fABlGHVu
InChI InChI=1S/C21H18N6O2/c22-18-16-12-24-27(15-9-5-2-6-10-15)20(16)26-19(25-18)17(13-28)21(29)23-11-14-7-3-1-4-8-14/h1-10,12-13,26H,11H2,(H2,22,25)(H,23,29)/b19-17-
InChIKey UWGHNRPJURHLNN-ZPHPHTNESA-N
Mol Weight 386.42 g/mol
Molecular Formula C21H18N6O2
Exact Mass 386.149124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8g75aQEjNNc
Name 2-(4-amino-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-6(7H)-ylidene)-N-benzyl-3-oxopropanamide
Alternate Name(s) (E)-2-(4-amino-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-6(7H)-ylidene)-N-benzyl-3-oxopropanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N6O2
InChI InChI=1S/C21H18N6O2/c22-18-16-12-24-27(15-9-5-2-6-10-15)20(16)26-19(25-18)17(13-28)21(29)23-11-14-7-3-1-4-8-14/h1-10,12-13,26H,11H2,(H2,22,25)(H,23,29)/b19-17-
InChIKey UWGHNRPJURHLNN-ZPHPHTNESA-N
Literature Reference DOI 10.1002/ardp.201000188
Molecular Weight 386.415 g/mol
SMILES N1\C(N=C(c2c1[n](nc2)-c1ccccc1)N)=C/(C(NCc1ccccc1)=O)C=O
SPLASH splash10-0a4i-7920000000-0d67d33fc1648c2b1bad
Source of Spectrum APC-344-193-14a
Wiley ID 1769224