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

Systemtic Name: 2-(1-tert-butyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(1-tert-butyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: 2-(1-tert-butyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(1-tert-butyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-benzyl-2-(1-tert-butyl-4-keto-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C18H21N5O2 MolecularWeight: 339.39164

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O2/c1-18(2,3)23-16-14(10-21-23)17(25)22(12-20-16)11-15(24)19-9-13-7-5-4-6-8-13/h4-8,10,12H,9,11H2,1-3H3,(H,19,24)