8-butyl-2,4-dimethyl-6,7-diphenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 8-butyl-2,4-dimethyl-6,7-diphenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 8-butyl-2,4-dimethyl-6,7-diphenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 8-butyl-2,4-dimethyl-6,7-diphenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 8-butyl-2,4-dimethyl-6,7-diphenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 8-butyl-2,4-dimethyl-6,7-diphenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C2=NC3=C(N12)C(=O)N(C(=O)N3C)C)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=C(N(C2=NC3=C(N12)C(=O)N(C(=O)N3C)C)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H25N5O2/c1-4-5-16-19-20(17-12-8-6-9-13-17)29(18-14-10-7-11-15-18)24-26-22-21(30(19)24)23(31)28(3)25(32)27(22)2/h6-15H,4-5,16H2,1-3H3