1,3-dimethyl-8-(oxan-4-ylamino)-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(oxan-4-ylamino)-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-(tetrahydropyran-4-ylamino)-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-(4-oxanylamino)-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(oxan-4-ylamino)-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-(tetrahydropyran-4-ylamino)-7H-purine-2,6-quinone Formula: C12H17N5O3 MolecularWeight: 279.29508

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)NC3CCOCC3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)NC3CCOCC3

InChI

InChI=1S/C12H17N5O3/c1-16-9-8(10(18)17(2)12(16)19)14-11(15-9)13-7-3-5-20-6-4-7/h7H,3-6H2,1-2H3,(H2,13,14,15)