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

Systemtic Name: 9-(3,4-dichlorophenyl)-8-oxidanylidene-2-phenethyl-7H-purine-6-carboxamide Openeye Name: 9-(3,4-dichlorophenyl)-8-oxo-2-phenethyl-7H-purine-6-carboxamide CAS Name: 9-(3,4-dichlorophenyl)-8-oxo-2-phenethyl-7H-purine-6-carboxamide IUPAC Name: 9-(3,4-dichlorophenyl)-8-oxo-2-phenethyl-7H-purine-6-carboxamide Traditional Name: 9-(3,4-dichlorophenyl)-8-keto-2-phenethyl-7H-purine-6-carboxamide Formula: C20H15Cl2N5O2 MolecularWeight: 428.2714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C=C4)Cl)Cl)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C=C4)Cl)Cl)C(=O)N

InChI

InChI=1S/C20H15Cl2N5O2/c21-13-8-7-12(10-14(13)22)27-19-17(26-20(27)29)16(18(23)28)24-15(25-19)9-6-11-4-2-1-3-5-11/h1-5,7-8,10H,6,9H2,(H2,23,28)(H,26,29)