3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-[(2-methylphenyl)methyl]-2H-purin-6-one

Systemtic Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-[(2-methylphenyl)methyl]-2H-purin-6-one Openeye Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(o-tolylmethyl)-2H-purin-6-one CAS Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-[(2-methylphenyl)methyl]-2H-purin-6-one IUPAC Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-[(2-methylphenyl)methyl]-2H-purin-6-one Traditional Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(2-methylbenzyl)-2H-purin-6-one Formula: C22H22Cl2N4O MolecularWeight: 429.34228

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CC=CC=C3C)C(=O)N(CN2C4=C(C=C(C=C4)Cl)Cl)C

Isomeric SMILES

CCC1=NC2=C(N1CC3=CC=CC=C3C)C(=O)N(CN2C4=C(C=C(C=C4)Cl)Cl)C

InChI

InChI=1S/C22H22Cl2N4O/c1-4-19-25-21-20(27(19)12-15-8-6-5-7-14(15)2)22(29)26(3)13-28(21)18-10-9-16(23)11-17(18)24/h5-11H,4,12-13H2,1-3H3