2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-phenyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-phenyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(8-bromo-1,3-dimethyl-2,6-dioxo-purin-9-yl)-N-phenyl-acetamide CAS Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxo-9-purinyl)-N-phenyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(8-bromo-1,3-dimethyl-2,6-dioxopurin-9-yl)-N-phenylacetamide Traditional Name: N-benzyl-2-(8-bromo-2,6-diketo-1,3-dimethyl-purin-9-yl)-N-phenyl-acetamide Formula: C22H20BrN5O3 MolecularWeight: 482.3299

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4)Br

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C22H20BrN5O3/c1-25-19-18(20(30)26(2)22(25)31)24-21(23)28(19)14-17(29)27(16-11-7-4-8-12-16)13-15-9-5-3-6-10-15/h3-12H,13-14H2,1-2H3