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

Systemtic Name: 6-cyclohexyl-4,7,8-trimethyl-2-(3-methylbutyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-cyclohexyl-2-isopentyl-4,7,8-trimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-cyclohexyl-4,7,8-trimethyl-2-(3-methylbutyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-cyclohexyl-4,7,8-trimethyl-2-(3-methylbutyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-cyclohexyl-2-isoamyl-4,7,8-trimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C21H31N5O2 MolecularWeight: 385.50314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C3=C(N=C2N1C4CCCCC4)N(C(=O)N(C3=O)CCC(C)C)C)C

Isomeric SMILES

CC1=C(N2C3=C(N=C2N1C4CCCCC4)N(C(=O)N(C3=O)CCC(C)C)C)C

InChI

InChI=1S/C21H31N5O2/c1-13(2)11-12-24-19(27)17-18(23(5)21(24)28)22-20-25(14(3)15(4)26(17)20)16-9-7-6-8-10-16/h13,16H,6-12H2,1-5H3