5-(4-azanyl-1-cyclobutyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromanyl-phenol

Systemtic Name: 5-(4-azanyl-1-cyclobutyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromanyl-phenol Openeye Name: 5-(4-amino-1-cyclobutyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromo-phenol CAS Name: 5-(4-amino-1-cyclobutyl-3-pyrazolo[3,4-d]pyrimidinyl)-2-bromophenol IUPAC Name: 5-(4-amino-1-cyclobutylpyrazolo[3,4-d]pyrimidin-3-yl)-2-bromophenol Traditional Name: 5-(4-amino-1-cyclobutyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromo-phenol Formula: C15H14BrN5O MolecularWeight: 360.20856

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2C3=C(C(=N2)C4=CC(=C(C=C4)Br)O)C(=NC=N3)N

Isomeric SMILES

C1CC(C1)N2C3=C(C(=N2)C4=CC(=C(C=C4)Br)O)C(=NC=N3)N

InChI

InChI=1S/C15H14BrN5O/c16-10-5-4-8(6-11(10)22)13-12-14(17)18-7-19-15(12)21(20-13)9-2-1-3-9/h4-7,9,22H,1-3H2,(H2,17,18,19)