1-ethyl-3-methyl-8-(1H-pyrazol-4-yl)-7H-purine-2,6-dione

Systemtic Name: 1-ethyl-3-methyl-8-(1H-pyrazol-4-yl)-7H-purine-2,6-dione Openeye Name: 1-ethyl-3-methyl-8-(1H-pyrazol-4-yl)-7H-purine-2,6-dione CAS Name: 1-ethyl-3-methyl-8-(1H-pyrazol-4-yl)-7H-purine-2,6-dione IUPAC Name: 1-ethyl-3-methyl-8-(1H-pyrazol-4-yl)-7H-purine-2,6-dione Traditional Name: 1-ethyl-3-methyl-8-(1H-pyrazol-4-yl)-7H-purine-2,6-quinone Formula: C11H12N6O2 MolecularWeight: 260.25198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C(N2)C3=CNN=C3)N(C1=O)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C(N2)C3=CNN=C3)N(C1=O)C

InChI

InChI=1S/C11H12N6O2/c1-3-17-10(18)7-9(16(2)11(17)19)15-8(14-7)6-4-12-13-5-6/h4-5H,3H2,1-2H3,(H,12,13)(H,14,15)