7-ethyl-1,3-dimethyl-8-(2-oxidanylpropylamino)purine-2,6-dione

Systemtic Name: 7-ethyl-1,3-dimethyl-8-(2-oxidanylpropylamino)purine-2,6-dione Openeye Name: 7-ethyl-8-(2-hydroxypropylamino)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-ethyl-8-(2-hydroxypropylamino)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-ethyl-8-(2-hydroxypropylamino)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-ethyl-8-(2-hydroxypropylamino)-1,3-dimethyl-xanthine Formula: C12H19N5O3 MolecularWeight: 281.31096

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1NCC(C)O)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCN1C2=C(N=C1NCC(C)O)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C12H19N5O3/c1-5-17-8-9(14-11(17)13-6-7(2)18)15(3)12(20)16(4)10(8)19/h7,18H,5-6H2,1-4H3,(H,13,14)