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

Systemtic Name: 4,7-dimethyl-2-(3-methylbutyl)-6-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-isopentyl-4,7-dimethyl-6-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-2-(3-methylbutyl)-6-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-2-(3-methylbutyl)-6-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-isoamyl-4,7-dimethyl-6-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O2/c1-13(2)10-11-23-18(26)16-17(22(4)20(23)27)21-19-24(16)12-14(3)25(19)15-8-6-5-7-9-15/h5-9,12-13H,10-11H2,1-4H3