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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)O

Isomeric SMILES

CC(CNCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)O

InChI

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