2,7-dimethyl-6-pentan-3-yloxy-9-(2,4,6-trimethylphenyl)purin-8-one

Systemtic Name: 2,7-dimethyl-6-pentan-3-yloxy-9-(2,4,6-trimethylphenyl)purin-8-one Openeye Name: 6-(1-ethylpropoxy)-2,7-dimethyl-9-(2,4,6-trimethylphenyl)purin-8-one CAS Name: 2,7-dimethyl-6-pentan-3-yloxy-9-(2,4,6-trimethylphenyl)-8-purinone IUPAC Name: 2,7-dimethyl-6-pentan-3-yloxy-9-(2,4,6-trimethylphenyl)purin-8-one Traditional Name: 6-(1-ethylpropoxy)-9-mesityl-2,7-dimethyl-purin-8-one Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1=NC(=NC2=C1N(C(=O)N2C3=C(C=C(C=C3C)C)C)C)C

Isomeric SMILES

CCC(CC)OC1=NC(=NC2=C1N(C(=O)N2C3=C(C=C(C=C3C)C)C)C)C

InChI

InChI=1S/C21H28N4O2/c1-8-16(9-2)27-20-18-19(22-15(6)23-20)25(21(26)24(18)7)17-13(4)10-12(3)11-14(17)5/h10-11,16H,8-9H2,1-7H3