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

Systemtic Name: 4,7-dimethyl-2-[(2R)-3-oxidanylidenebutan-2-yl]-6-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4,7-dimethyl-2-[(1R)-1-methyl-2-oxo-propyl]-6-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-2-[(2R)-3-oxobutan-2-yl]-6-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-2-[(2R)-3-oxobutan-2-yl]-6-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-[(1R)-2-keto-1-methyl-propyl]-4,7-dimethyl-6-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1C4=CC=CC=C4)N(C(=O)N(C3=O)C(C)C(=O)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1C4=CC=CC=C4)N(C(=O)N(C3=O)[C@H](C)C(=O)C)C

InChI

InChI=1S/C19H19N5O3/c1-11-10-22-15-16(20-18(22)23(11)14-8-6-5-7-9-14)21(4)19(27)24(17(15)26)12(2)13(3)25/h5-10,12H,1-4H3/t12-/m1/s1