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

Systemtic Name: 2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-(2-methylpropylcarbamoyl)ethanamide Openeye Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxo-purin-9-yl)-N-(isobutylcarbamoyl)acetamide CAS Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxo-9-purinyl)-N-[(2-methylpropylamino)-oxomethyl]acetamide IUPAC Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxopurin-9-yl)-N-(2-methylpropylcarbamoyl)acetamide Traditional Name: 2-(8-bromo-2,6-diketo-1,3-dimethyl-purin-9-yl)-N-(isobutylcarbamoyl)acetamide Formula: C14H19BrN6O4 MolecularWeight: 415.24246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1Br

Isomeric SMILES

CC(C)CNC(=O)NC(=O)CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1Br

InChI

InChI=1S/C14H19BrN6O4/c1-7(2)5-16-13(24)17-8(22)6-21-10-9(18-12(21)15)11(23)20(4)14(25)19(10)3/h7H,5-6H2,1-4H3,(H2,16,17,22,24)