8-(2-hydroxyethylamino)-1,3-dimethyl-7-propyl-purine-2,6-dione

Systemtic Name: 8-(2-hydroxyethylamino)-1,3-dimethyl-7-propyl-purine-2,6-dione Openeye Name: 8-(2-hydroxyethylamino)-1,3-dimethyl-7-propyl-purine-2,6-dione CAS Name: 8-(2-hydroxyethylamino)-1,3-dimethyl-7-propylpurine-2,6-dione IUPAC Name: 8-(2-hydroxyethylamino)-1,3-dimethyl-7-propylpurine-2,6-dione Traditional Name: 8-(2-hydroxyethylamino)-1,3-dimethyl-7-propyl-xanthine Formula: C12H19N5O3 MolecularWeight: 281.31096

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N=C1NCCO)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCN1C2=C(N=C1NCCO)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C12H19N5O3/c1-4-6-17-8-9(14-11(17)13-5-7-18)15(2)12(20)16(3)10(8)19/h18H,4-7H2,1-3H3,(H,13,14)