2-(1-tert-butyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-(1-tert-butyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-(1-tert-butyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-(1-tert-butyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-(1-tert-butyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-(1-tert-butyl-4-keto-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(4-fluorobenzyl)acetamide Formula: C18H20FN5O2 MolecularWeight: 357.382103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)N1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN5O2/c1-18(2,3)24-16-14(9-22-24)17(26)23(11-21-16)10-15(25)20-8-12-4-6-13(19)7-5-12/h4-7,9,11H,8,10H2,1-3H3,(H,20,25)