3-phenethyl-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 3-phenethyl-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-phenethyl-2H-triazolo[4,5-d]pyrimidin-7-one CAS Name: 3-phenethyl-2H-triazolo[4,5-d]pyrimidin-7-one IUPAC Name: 3-phenethyl-2H-triazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-phenethyl-2H-triazolo[4,5-d]pyrimidin-7-one Formula: C12H11N5O MolecularWeight: 241.24864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=NC=NC(=O)C3=NN2

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=NC=NC(=O)C3=NN2

InChI

InChI=1S/C12H11N5O/c18-12-10-11(13-8-14-12)17(16-15-10)7-6-9-4-2-1-3-5-9/h1-5,8,16H,6-7H2