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

Systemtic Name: 7-(4-ethylphenyl)-2,4-dimethyl-6-pentyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(4-ethylphenyl)-2,4-dimethyl-6-pentyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(4-ethylphenyl)-2,4-dimethyl-6-pentylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(4-ethylphenyl)-2,4-dimethyl-6-pentylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-amyl-7-(4-ethylphenyl)-2,4-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)CC

Isomeric SMILES

CCCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)CC

InChI

InChI=1S/C22H27N5O2/c1-5-7-8-13-26-17(16-11-9-15(6-2)10-12-16)14-27-18-19(23-21(26)27)24(3)22(29)25(4)20(18)28/h9-12,14H,5-8,13H2,1-4H3