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

Systemtic Name: 5-(4-azanyl-1-methyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromanyl-phenol Openeye Name: 5-(4-amino-1-methyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromo-phenol CAS Name: 5-(4-amino-1-methyl-3-pyrazolo[3,4-d]pyrimidinyl)-2-bromophenol IUPAC Name: 5-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-2-bromophenol Traditional Name: 5-(4-amino-1-methyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-bromo-phenol Formula: C12H10BrN5O MolecularWeight: 320.1447

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=N1)C3=CC(=C(C=C3)Br)O)C(=NC=N2)N

Isomeric SMILES

CN1C2=C(C(=N1)C3=CC(=C(C=C3)Br)O)C(=NC=N2)N

InChI

InChI=1S/C12H10BrN5O/c1-18-12-9(11(14)15-5-16-12)10(17-18)6-2-3-7(13)8(19)4-6/h2-5,19H,1H3,(H2,14,15,16)