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

Systemtic Name: 3-(2,4-dichlorophenyl)-7-heptan-4-yl-1-methyl-2H-purin-6-one Openeye Name: 3-(2,4-dichlorophenyl)-1-methyl-7-(1-propylbutyl)-2H-purin-6-one CAS Name: 3-(2,4-dichlorophenyl)-7-heptan-4-yl-1-methyl-2H-purin-6-one IUPAC Name: 3-(2,4-dichlorophenyl)-7-heptan-4-yl-1-methyl-2H-purin-6-one Traditional Name: 3-(2,4-dichlorophenyl)-1-methyl-7-(1-propylbutyl)-2H-purin-6-one Formula: C19H24Cl2N4O MolecularWeight: 395.32606

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C=NC2=C1C(=O)N(CN2C3=C(C=C(C=C3)Cl)Cl)C

Isomeric SMILES

CCCC(CCC)N1C=NC2=C1C(=O)N(CN2C3=C(C=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C19H24Cl2N4O/c1-4-6-14(7-5-2)24-11-22-18-17(24)19(26)23(3)12-25(18)16-9-8-13(20)10-15(16)21/h8-11,14H,4-7,12H2,1-3H3