8-(dimethylamino)-3-methyl-7-prop-2-enyl-purine-2,6-dione

Systemtic Name: 8-(dimethylamino)-3-methyl-7-prop-2-enyl-purine-2,6-dione Openeye Name: 7-allyl-8-(dimethylamino)-3-methyl-purine-2,6-dione CAS Name: 8-(dimethylamino)-3-methyl-7-prop-2-enylpurine-2,6-dione IUPAC Name: 8-(dimethylamino)-3-methyl-7-prop-2-enylpurine-2,6-dione Traditional Name: 7-allyl-8-(dimethylamino)-3-methyl-xanthine Formula: C11H15N5O2 MolecularWeight: 249.2691

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)N(C)C)CC=C

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N(C)C)CC=C

InChI

InChI=1S/C11H15N5O2/c1-5-6-16-7-8(12-10(16)14(2)3)15(4)11(18)13-9(7)17/h5H,1,6H2,2-4H3,(H,13,17,18)