2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-phenyl-ethanamide Openeye Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-phenyl-acetamide CAS Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxo-7-purinyl)-N-phenylacetamide IUPAC Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxopurin-7-yl)-N-phenylacetamide Traditional Name: 2-(8-bromo-2,6-diketo-1,3-dimethyl-purin-7-yl)-N-phenyl-acetamide Formula: C15H14BrN5O3 MolecularWeight: 392.20736

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C15H14BrN5O3/c1-19-12-11(13(23)20(2)15(19)24)21(14(16)18-12)8-10(22)17-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,17,22)