3-(2,4-dichlorophenyl)-2,8-diethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one

Systemtic Name: 3-(2,4-dichlorophenyl)-2,8-diethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one Openeye Name: 3-(2,4-dichlorophenyl)-2,8-diethyl-1-methyl-7-(1-propylbutyl)-2H-purin-6-one CAS Name: 3-(2,4-dichlorophenyl)-2,8-diethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one IUPAC Name: 3-(2,4-dichlorophenyl)-2,8-diethyl-7-heptan-4-yl-1-methyl-2H-purin-6-one Traditional Name: 3-(2,4-dichlorophenyl)-2,8-diethyl-1-methyl-7-(1-propylbutyl)-2H-purin-6-one Formula: C23H32Cl2N4O MolecularWeight: 451.43238

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C(=NC2=C1C(=O)N(C(N2C3=C(C=C(C=C3)Cl)Cl)CC)C)CC

Isomeric SMILES

CCCC(CCC)N1C(=NC2=C1C(=O)N(C(N2C3=C(C=C(C=C3)Cl)Cl)CC)C)CC

InChI

InChI=1S/C23H32Cl2N4O/c1-6-10-16(11-7-2)28-19(8-3)26-22-21(28)23(30)27(5)20(9-4)29(22)18-13-12-15(24)14-17(18)25/h12-14,16,20H,6-11H2,1-5H3