6-cyclohexyl-4,7,8-trimethyl-2-[(3-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-cyclohexyl-4,7,8-trimethyl-2-[(3-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-cyclohexyl-4,7,8-trimethyl-2-(m-tolylmethyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-cyclohexyl-4,7,8-trimethyl-2-[(3-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-cyclohexyl-4,7,8-trimethyl-2-[(3-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-cyclohexyl-4,7,8-trimethyl-2-(3-methylbenzyl)purin[7,8-a]imidazole-1,3-quinone Formula: C24H29N5O2 MolecularWeight: 419.51936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=O)C3=C(N=C4N3C(=C(N4C5CCCCC5)C)C)N(C2=O)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=O)C3=C(N=C4N3C(=C(N4C5CCCCC5)C)C)N(C2=O)C

InChI

InChI=1S/C24H29N5O2/c1-15-9-8-10-18(13-15)14-27-22(30)20-21(26(4)24(27)31)25-23-28(16(2)17(3)29(20)23)19-11-6-5-7-12-19/h8-10,13,19H,5-7,11-12,14H2,1-4H3