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

Systemtic Name: 5-(4-azanyl-1-cyclopentyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromanyl-phenol Openeye Name: 5-(4-amino-1-cyclopentyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromo-phenol CAS Name: 5-(4-amino-1-cyclopentyl-3-pyrazolo[3,4-d]pyrimidinyl)-2-bromophenol IUPAC Name: 5-(4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidin-3-yl)-2-bromophenol Traditional Name: 5-(4-amino-1-cyclopentyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromo-phenol Formula: C16H16BrN5O MolecularWeight: 374.23514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C(=N2)C4=CC(=C(C=C4)Br)O)C(=NC=N3)N

Isomeric SMILES

C1CCC(C1)N2C3=C(C(=N2)C4=CC(=C(C=C4)Br)O)C(=NC=N3)N

InChI

InChI=1S/C16H16BrN5O/c17-11-6-5-9(7-12(11)23)14-13-15(18)19-8-20-16(13)22(21-14)10-3-1-2-4-10/h5-8,10,23H,1-4H2,(H2,18,19,20)