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

Systemtic Name: 6-cyclopentyl-4,7-dimethyl-2-(phenylmethyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-benzyl-6-cyclopentyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-cyclopentyl-4,7-dimethyl-2-(phenylmethyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-benzyl-6-cyclopentyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-benzyl-6-cyclopentyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1C4CCCC4)N(C(=O)N(C3=O)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1C4CCCC4)N(C(=O)N(C3=O)CC5=CC=CC=C5)C

InChI

InChI=1S/C21H23N5O2/c1-14-12-24-17-18(22-20(24)26(14)16-10-6-7-11-16)23(2)21(28)25(19(17)27)13-15-8-4-3-5-9-15/h3-5,8-9,12,16H,6-7,10-11,13H2,1-2H3