4-ethyl-3,7-dimethyl-1-pentan-3-yl-6-(2,4,6-trimethylphenyl)pyrazolo[5,1-b]purin-2-one

Systemtic Name: 4-ethyl-3,7-dimethyl-1-pentan-3-yl-6-(2,4,6-trimethylphenyl)pyrazolo[5,1-b]purin-2-one Openeye Name: 4-ethyl-1-(1-ethylpropyl)-3,7-dimethyl-6-(2,4,6-trimethylphenyl)pyrazolo[5,1-b]purin-2-one CAS Name: 4-ethyl-3,7-dimethyl-1-pentan-3-yl-6-(2,4,6-trimethylphenyl)-2-pyrazolo[5,1-b]purinone IUPAC Name: 4-ethyl-3,7-dimethyl-1-pentan-3-yl-6-(2,4,6-trimethylphenyl)pyrazolo[5,1-b]purin-2-one Traditional Name: 4-ethyl-1-(1-ethylpropyl)-6-mesityl-3,7-dimethyl-pyrazolo[5,1-b]purin-2-one Formula: C25H33N5O MolecularWeight: 419.56242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=NN2C3=C1N(C(=O)N3C(CC)CC)C)C)C4=C(C=C(C=C4C)C)C

Isomeric SMILES

CCC1=NC2=C(C(=NN2C3=C1N(C(=O)N3C(CC)CC)C)C)C4=C(C=C(C=C4C)C)C

InChI

InChI=1S/C25H33N5O/c1-9-18(10-2)29-24-22(28(8)25(29)31)19(11-3)26-23-21(17(7)27-30(23)24)20-15(5)12-14(4)13-16(20)6/h12-13,18H,9-11H2,1-8H3