1-[4-(4-azanyl-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]ethanone

Systemtic Name: 1-[4-(4-azanyl-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]ethanone Openeye Name: 1-[4-(4-amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]ethanone CAS Name: 1-[4-(4-amino-1-tert-butyl-3-pyrazolo[3,4-d]pyrimidinyl)phenyl]ethanone IUPAC Name: 1-[4-(4-amino-1-tert-butylpyrazolo[3,4-d]pyrimidin-3-yl)phenyl]ethanone Traditional Name: 1-[4-(4-amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]ethanone Formula: C17H19N5O MolecularWeight: 309.36566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=NN(C3=C2C(=NC=N3)N)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=NN(C3=C2C(=NC=N3)N)C(C)(C)C

InChI

InChI=1S/C17H19N5O/c1-10(23)11-5-7-12(8-6-11)14-13-15(18)19-9-20-16(13)22(21-14)17(2,3)4/h5-9H,1-4H3,(H2,18,19,20)