6-(3-methoxyphenyl)-4-methyl-2-[(2R)-3-oxidanylidenebutan-2-yl]-7-phenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(3-methoxyphenyl)-4-methyl-2-[(2R)-3-oxidanylidenebutan-2-yl]-7-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(3-methoxyphenyl)-4-methyl-2-[(1R)-1-methyl-2-oxo-propyl]-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(3-methoxyphenyl)-4-methyl-2-[(2R)-3-oxobutan-2-yl]-7-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(3-methoxyphenyl)-4-methyl-2-[(2R)-3-oxobutan-2-yl]-7-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-[(1R)-2-keto-1-methyl-propyl]-6-(3-methoxyphenyl)-4-methyl-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C25H23N5O4 MolecularWeight: 457.48122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)N1C(=O)C2=C(N=C3N2C=C(N3C4=CC(=CC=C4)OC)C5=CC=CC=C5)N(C1=O)C

Isomeric SMILES

C[C@H](C(=O)C)N1C(=O)C2=C(N=C3N2C=C(N3C4=CC(=CC=C4)OC)C5=CC=CC=C5)N(C1=O)C

InChI

InChI=1S/C25H23N5O4/c1-15(16(2)31)29-23(32)21-22(27(3)25(29)33)26-24-28(21)14-20(17-9-6-5-7-10-17)30(24)18-11-8-12-19(13-18)34-4/h5-15H,1-4H3/t15-/m1/s1