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

Systemtic Name: 6-(3-methoxypropyl)-4,7-dimethyl-2-(phenylmethyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-benzyl-6-(3-methoxypropyl)-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(3-methoxypropyl)-4,7-dimethyl-2-(phenylmethyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-benzyl-6-(3-methoxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-benzyl-6-(3-methoxypropyl)-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CCCOC)N(C(=O)N(C3=O)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CCCOC)N(C(=O)N(C3=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C20H23N5O3/c1-14-12-24-16-17(21-19(24)23(14)10-7-11-28-3)22(2)20(27)25(18(16)26)13-15-8-5-4-6-9-15/h4-6,8-9,12H,7,10-11,13H2,1-3H3