7-(2-dimethylaminoethyl)-1-methyl-3-propyl-purine-2,6-dione

Systemtic Name: 7-(2-dimethylaminoethyl)-1-methyl-3-propyl-purine-2,6-dione Openeye Name: 7-(2-dimethylaminoethyl)-1-methyl-3-propyl-purine-2,6-dione CAS Name: 7-(2-dimethylaminoethyl)-1-methyl-3-propylpurine-2,6-dione IUPAC Name: 7-(2-dimethylaminoethyl)-1-methyl-3-propylpurine-2,6-dione Traditional Name: 7-(2-dimethylaminoethyl)-1-methyl-3-propyl-xanthine Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN(C)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN(C)C

InChI

InChI=1S/C13H21N5O2/c1-5-6-18-11-10(12(19)16(4)13(18)20)17(9-14-11)8-7-15(2)3/h9H,5-8H2,1-4H3