9-(4-tert-butylphenyl)-2-(2,4-dichlorophenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(4-tert-butylphenyl)-2-(2,4-dichlorophenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(4-tert-butylphenyl)-2-(2,4-dichlorophenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(4-tert-butylphenyl)-2-(2,4-dichlorophenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(4-tert-butylphenyl)-2-(2,4-dichlorophenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-(4-tert-butylphenyl)-2-(2,4-dichlorophenyl)-8-keto-7H-purine-6-carboxamide Formula: C22H19Cl2N5O2 MolecularWeight: 456.32456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H19Cl2N5O2/c1-22(2,3)11-4-7-13(8-5-11)29-20-17(27-21(29)31)16(18(25)30)26-19(28-20)14-9-6-12(23)10-15(14)24/h4-10H,1-3H3,(H2,25,30)(H,27,31)