3-(1-tert-butyl-3-methyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[(4-fluorophenyl)methyl]azetidine-1-carboxamide

Systemtic Name: 3-(1-tert-butyl-3-methyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[(4-fluorophenyl)methyl]azetidine-1-carboxamide Openeye Name: 3-(1-tert-butyl-3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[(4-fluorophenyl)methyl]azetidine-1-carboxamide CAS Name: 3-(1-tert-butyl-3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[(4-fluorophenyl)methyl]-1-azetidinecarboxamide IUPAC Name: 3-(1-tert-butyl-3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-[(4-fluorophenyl)methyl]azetidine-1-carboxamide Traditional Name: 3-(1-tert-butyl-4-keto-3-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-(4-fluorobenzyl)azetidine-1-carboxamide Formula: C21H25FN6O2 MolecularWeight: 412.460603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=NC2=O)C3CN(C3)C(=O)NCC4=CC=C(C=C4)F)N(N1)C(C)(C)C

Isomeric SMILES

CC1=C2C(=NC(=NC2=O)C3CN(C3)C(=O)NCC4=CC=C(C=C4)F)N(N1)C(C)(C)C

InChI

InChI=1S/C21H25FN6O2/c1-12-16-18(28(26-12)21(2,3)4)24-17(25-19(16)29)14-10-27(11-14)20(30)23-9-13-5-7-15(22)8-6-13/h5-8,14,26H,9-11H2,1-4H3,(H,23,30)