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

Systemtic Name: 6-(3-methoxypropyl)-4,7-dimethyl-2-(3-methylbutyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-isopentyl-6-(3-methoxypropyl)-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(3-methoxypropyl)-4,7-dimethyl-2-(3-methylbutyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(3-methoxypropyl)-4,7-dimethyl-2-(3-methylbutyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 2-isoamyl-6-(3-methoxypropyl)-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C18H27N5O3 MolecularWeight: 361.43868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CCCOC)N(C(=O)N(C3=O)CCC(C)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CCCOC)N(C(=O)N(C3=O)CCC(C)C)C

InChI

InChI=1S/C18H27N5O3/c1-12(2)7-9-22-16(24)14-15(20(4)18(22)25)19-17-21(8-6-10-26-5)13(3)11-23(14)17/h11-12H,6-10H2,1-5H3