3-[2-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)ethynyl]phenol

Systemtic Name: 3-[2-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)ethynyl]phenol Openeye Name: 3-[2-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)ethynyl]phenol CAS Name: 3-[2-(4-amino-1-propan-2-yl-3-pyrazolo[3,4-d]pyrimidinyl)ethynyl]phenol IUPAC Name: 3-[2-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)ethynyl]phenol Traditional Name: 3-[2-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)ethynyl]phenol Formula: C16H15N5O MolecularWeight: 293.3232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=N1)C#CC3=CC(=CC=C3)O)C(=NC=N2)N

Isomeric SMILES

CC(C)N1C2=C(C(=N1)C#CC3=CC(=CC=C3)O)C(=NC=N2)N

InChI

InChI=1S/C16H15N5O/c1-10(2)21-16-14(15(17)18-9-19-16)13(20-21)7-6-11-4-3-5-12(22)8-11/h3-5,8-10,22H,1-2H3,(H2,17,18,19)