9-(2,3-dimethoxyphenyl)-2-(4-methylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(2,3-dimethoxyphenyl)-2-(4-methylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(2,3-dimethoxyphenyl)-8-oxo-2-(p-tolyl)-7H-purine-6-carboxamide CAS Name: 9-(2,3-dimethoxyphenyl)-2-(4-methylphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(2,3-dimethoxyphenyl)-2-(4-methylphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-(2,3-dimethoxyphenyl)-8-keto-2-(p-tolyl)-7H-purine-6-carboxamide Formula: C21H19N5O4 MolecularWeight: 405.40666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=C(C(=CC=C4)OC)OC)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=C(C(=CC=C4)OC)OC)C(=O)N

InChI

InChI=1S/C21H19N5O4/c1-11-7-9-12(10-8-11)19-23-15(18(22)27)16-20(25-19)26(21(28)24-16)13-5-4-6-14(29-2)17(13)30-3/h4-10H,1-3H3,(H2,22,27)(H,24,28)