1,3-dimethyl-8-pyridin-3-yl-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-pyridin-3-yl-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-(3-pyridyl)-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-(3-pyridinyl)-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-pyridin-3-yl-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-(3-pyridyl)-7H-purine-2,6-quinone Formula: C12H11N5O2 MolecularWeight: 257.24804

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CN=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C12H11N5O2/c1-16-10-8(11(18)17(2)12(16)19)14-9(15-10)7-4-3-5-13-6-7/h3-6H,1-2H3,(H,14,15)