3-phenyl-1,9-dihydro-[1,2,4]triazolo[3,4-f]purin-5-one

Systemtic Name: 3-phenyl-1,9-dihydro-[1,2,4]triazolo[3,4-f]purin-5-one Openeye Name: 3-phenyl-1,9-dihydro-[1,2,4]triazolo[3,4-f]purin-5-one CAS Name: 3-phenyl-1,9-dihydro-[1,2,4]triazolo[3,4-f]purin-5-one IUPAC Name: 3-phenyl-1,9-dihydro-[1,2,4]triazolo[3,4-f]purin-5-one Traditional Name: 3-phenyl-1,9-dihydro-[1,2,4]triazolo[3,4-f]purin-5-one Formula: C12H8N6O MolecularWeight: 252.23152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC3=C4C(=NC(=O)N32)N=CN4

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC3=C4C(=NC(=O)N32)N=CN4

InChI

InChI=1S/C12H8N6O/c19-12-15-9-8(13-6-14-9)11-17-16-10(18(11)12)7-4-2-1-3-5-7/h1-6,17H,(H,13,14,15,19)