8-ethyl-7-heptan-4-yl-3-[(4-methoxyphenyl)methyl]-1-methyl-2H-purin-6-one

Systemtic Name: 8-ethyl-7-heptan-4-yl-3-[(4-methoxyphenyl)methyl]-1-methyl-2H-purin-6-one Openeye Name: 8-ethyl-3-[(4-methoxyphenyl)methyl]-1-methyl-7-(1-propylbutyl)-2H-purin-6-one CAS Name: 8-ethyl-7-heptan-4-yl-3-[(4-methoxyphenyl)methyl]-1-methyl-2H-purin-6-one IUPAC Name: 8-ethyl-7-heptan-4-yl-3-[(4-methoxyphenyl)methyl]-1-methyl-2H-purin-6-one Traditional Name: 8-ethyl-1-methyl-3-p-anisyl-7-(1-propylbutyl)-2H-purin-6-one Formula: C23H34N4O2 MolecularWeight: 398.54166

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C(=NC2=C1C(=O)N(CN2CC3=CC=C(C=C3)OC)C)CC

Isomeric SMILES

CCCC(CCC)N1C(=NC2=C1C(=O)N(CN2CC3=CC=C(C=C3)OC)C)CC

InChI

InChI=1S/C23H34N4O2/c1-6-9-18(10-7-2)27-20(8-3)24-22-21(27)23(28)25(4)16-26(22)15-17-11-13-19(29-5)14-12-17/h11-14,18H,6-10,15-16H2,1-5H3