1,3-dimethyl-8-(methylamino)-7-(2-methylprop-2-enyl)purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(methylamino)-7-(2-methylprop-2-enyl)purine-2,6-dione Openeye Name: 1,3-dimethyl-7-(2-methylallyl)-8-(methylamino)purine-2,6-dione CAS Name: 1,3-dimethyl-8-(methylamino)-7-(2-methylprop-2-enyl)purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(methylamino)-7-(2-methylprop-2-enyl)purine-2,6-dione Traditional Name: 1,3-dimethyl-7-(2-methylallyl)-8-(methylamino)xanthine Formula: C12H17N5O2 MolecularWeight: 263.29568

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C2=C(N=C1NC)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CC(=C)CN1C2=C(N=C1NC)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C12H17N5O2/c1-7(2)6-17-8-9(14-11(17)13-3)15(4)12(19)16(5)10(8)18/h1,6H2,2-5H3,(H,13,14)