4-methyl-2-(phenylmethyl)-6H-[1,2,4]triazolo[5,1-b]purin-5-one

Systemtic Name: 4-methyl-2-(phenylmethyl)-6H-[1,2,4]triazolo[5,1-b]purin-5-one Openeye Name: 2-benzyl-4-methyl-6H-[1,2,4]triazolo[5,1-b]purin-5-one CAS Name: 4-methyl-2-(phenylmethyl)-6H-[1,2,4]triazolo[5,1-b]purin-5-one IUPAC Name: 2-benzyl-4-methyl-6H-[1,2,4]triazolo[5,1-b]purin-5-one Traditional Name: 2-benzyl-4-methyl-6H-[1,2,4]triazolo[5,1-b]purin-5-one Formula: C14H12N6O MolecularWeight: 280.28468

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=CN2)N3C1=NC(=N3)CC4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(N=CN2)N3C1=NC(=N3)CC4=CC=CC=C4

InChI

InChI=1S/C14H12N6O/c1-19-13(21)11-12(16-8-15-11)20-14(19)17-10(18-20)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,15,16)