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

Systemtic Name: 7-[2-(ethylamino)-2-phenyl-ethyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[2-(ethylamino)-2-phenyl-ethyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[2-(ethylamino)-2-phenylethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[2-(ethylamino)-2-phenylethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[2-(ethylamino)-2-phenyl-ethyl]-1,3-dimethyl-xanthine Formula: C17H21N5O2 MolecularWeight: 327.38094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(CN1C=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=CC=C3

Isomeric SMILES

CCNC(CN1C=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=CC=C3

InChI

InChI=1S/C17H21N5O2/c1-4-18-13(12-8-6-5-7-9-12)10-22-11-19-15-14(22)16(23)21(3)17(24)20(15)2/h5-9,11,13,18H,4,10H2,1-3H3