3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(naphthalen-1-ylmethyl)-2H-purin-6-one

Systemtic Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(naphthalen-1-ylmethyl)-2H-purin-6-one Openeye Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(1-naphthylmethyl)-2H-purin-6-one CAS Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(1-naphthalenylmethyl)-2H-purin-6-one IUPAC Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(naphthalen-1-ylmethyl)-2H-purin-6-one Traditional Name: 3-(2,4-dichlorophenyl)-8-ethyl-1-methyl-7-(1-naphthylmethyl)-2H-purin-6-one Formula: C25H22Cl2N4O MolecularWeight: 465.37438

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CC=CC4=CC=CC=C43)C(=O)N(CN2C5=C(C=C(C=C5)Cl)Cl)C

Isomeric SMILES

CCC1=NC2=C(N1CC3=CC=CC4=CC=CC=C43)C(=O)N(CN2C5=C(C=C(C=C5)Cl)Cl)C

InChI

InChI=1S/C25H22Cl2N4O/c1-3-22-28-24-23(30(22)14-17-9-6-8-16-7-4-5-10-19(16)17)25(32)29(2)15-31(24)21-12-11-18(26)13-20(21)27/h4-13H,3,14-15H2,1-2H3