6-ethyl-4,7-dimethyl-2-[(E)-3-phenylprop-2-enyl]purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-ethyl-4,7-dimethyl-2-[(E)-3-phenylprop-2-enyl]purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-[(E)-cinnamyl]-6-ethyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-ethyl-4,7-dimethyl-2-[(E)-3-phenylprop-2-enyl]purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-ethyl-4,7-dimethyl-2-[(E)-3-phenylprop-2-enyl]purino[7,8-a]imidazole-1,3-dione Traditional Name: 2-[(E)-cinnamyl]-6-ethyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC=CC4=CC=CC=C4)C

Isomeric SMILES

CCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C/C=C/C4=CC=CC=C4)C

InChI

InChI=1S/C20H21N5O2/c1-4-23-14(2)13-25-16-17(21-19(23)25)22(3)20(27)24(18(16)26)12-8-11-15-9-6-5-7-10-15/h5-11,13H,4,12H2,1-3H3/b11-8+