2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-cyano-3-methyl-butan-2-yl)ethanamide

Systemtic Name: 2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-cyano-3-methyl-butan-2-yl)ethanamide Openeye Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(1-cyano-1,2-dimethyl-propyl)acetamide CAS Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(2-cyano-3-methylbutan-2-yl)acetamide IUPAC Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-cyano-3-methylbutan-2-yl)acetamide Traditional Name: 2-(8-chloro-2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(1-cyano-1,2-dimethyl-propyl)acetamide Formula: C15H19ClN6O3 MolecularWeight: 366.80276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CN1C2=C(N=C1Cl)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)CN1C2=C(N=C1Cl)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C15H19ClN6O3/c1-8(2)15(3,7-17)19-9(23)6-22-10-11(18-13(22)16)20(4)14(25)21(5)12(10)24/h8H,6H2,1-5H3,(H,19,23)