2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-[(4-methoxyphenyl)methyl]purin-8-one

Systemtic Name: 2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-[(4-methoxyphenyl)methyl]purin-8-one Openeye Name: 2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-[(4-methoxyphenyl)methyl]purin-8-one CAS Name: 2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-[(4-methoxyphenyl)methyl]-8-purinone IUPAC Name: 2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-[(4-methoxyphenyl)methyl]purin-8-one Traditional Name: 2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-p-anisyl-purin-8-one Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=CN=C(N=C3N(C2=O)C4=CC(=CC=C4)OC)NC5CC5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=CN=C(N=C3N(C2=O)C4=CC(=CC=C4)OC)NC5CC5

InChI

InChI=1S/C23H23N5O3/c1-30-18-10-6-15(7-11-18)14-27-20-13-24-22(25-16-8-9-16)26-21(20)28(23(27)29)17-4-3-5-19(12-17)31-2/h3-7,10-13,16H,8-9,14H2,1-2H3,(H,24,25,26)