7-(3-chloranyl-4-methoxy-phenyl)-2,4-dimethyl-6-phenethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 7-(3-chloranyl-4-methoxy-phenyl)-2,4-dimethyl-6-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(3-chloro-4-methoxy-phenyl)-2,4-dimethyl-6-phenethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(3-chloro-4-methoxyphenyl)-2,4-dimethyl-6-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(3-chloro-4-methoxyphenyl)-2,4-dimethyl-6-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 7-(3-chloro-4-methoxy-phenyl)-2,4-dimethyl-6-phenethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C24H22ClN5O3 MolecularWeight: 463.91618

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCC4=CC=CC=C4)C5=CC(=C(C=C5)OC)Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCC4=CC=CC=C4)C5=CC(=C(C=C5)OC)Cl

InChI

InChI=1S/C24H22ClN5O3/c1-27-21-20(22(31)28(2)24(27)32)30-14-18(16-9-10-19(33-3)17(25)13-16)29(23(30)26-21)12-11-15-7-5-4-6-8-15/h4-10,13-14H,11-12H2,1-3H3