4-(3-bromanylphenoxy)-1-methyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-(3-bromanylphenoxy)-1-methyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(3-bromophenoxy)-1-methyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-(3-bromophenoxy)-1-methylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-(3-bromophenoxy)-1-methylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(3-bromophenoxy)-1-methyl-pyrazolo[3,4-d]pyrimidine Formula: C12H9BrN4O MolecularWeight: 305.13006

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)OC3=CC(=CC=C3)Br

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)OC3=CC(=CC=C3)Br

InChI

InChI=1S/C12H9BrN4O/c1-17-11-10(6-16-17)12(15-7-14-11)18-9-4-2-3-8(13)5-9/h2-7H,1H3