9-(3,4-dichlorophenyl)-2-(3-ethoxy-4-methoxy-phenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(3,4-dichlorophenyl)-2-(3-ethoxy-4-methoxy-phenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(3,4-dichlorophenyl)-2-(3-ethoxy-4-methoxy-phenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(3,4-dichlorophenyl)-2-(3-ethoxy-4-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(3,4-dichlorophenyl)-2-(3-ethoxy-4-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-(3,4-dichlorophenyl)-2-(3-ethoxy-4-methoxy-phenyl)-8-keto-7H-purine-6-carboxamide Formula: C21H17Cl2N5O4 MolecularWeight: 474.29678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C=C4)Cl)Cl)C(=O)N)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C=C4)Cl)Cl)C(=O)N)OC

InChI

InChI=1S/C21H17Cl2N5O4/c1-3-32-15-8-10(4-7-14(15)31-2)19-25-16(18(24)29)17-20(27-19)28(21(30)26-17)11-5-6-12(22)13(23)9-11/h4-9H,3H2,1-2H3,(H2,24,29)(H,26,30)