4,7-dimethyl-6-[[(2R)-oxolan-2-yl]methyl]-2-phenethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7-dimethyl-6-[[(2R)-oxolan-2-yl]methyl]-2-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4,7-dimethyl-2-phenethyl-6-[[(2R)-tetrahydrofuran-2-yl]methyl]purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-6-[[(2R)-2-oxolanyl]methyl]-2-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-6-[[(2R)-oxolan-2-yl]methyl]-2-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 4,7-dimethyl-2-phenethyl-6-[[(2R)-tetrahydrofuran-2-yl]methyl]purin[7,8-a]imidazole-1,3-quinone Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CC4CCCO4)N(C(=O)N(C3=O)CCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1C[C@H]4CCCO4)N(C(=O)N(C3=O)CCC5=CC=CC=C5)C

InChI

InChI=1S/C22H25N5O3/c1-15-13-27-18-19(23-21(27)26(15)14-17-9-6-12-30-17)24(2)22(29)25(20(18)28)11-10-16-7-4-3-5-8-16/h3-5,7-8,13,17H,6,9-12,14H2,1-2H3/t17-/m1/s1