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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-9-(3-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-8-keto-9-(3-methoxyphenyl)-7H-purine-6-carboxamide Formula: C21H19N5O5 MolecularWeight: 421.40606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=CC=C4)OC)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=CC=C4)OC)C(=O)N)OC

InChI

InChI=1S/C21H19N5O5/c1-29-13-6-4-5-12(10-13)26-20-17(24-21(26)28)16(18(22)27)23-19(25-20)11-7-8-14(30-2)15(9-11)31-3/h4-10H,1-3H3,(H2,22,27)(H,24,28)