2-[3-butyl-7-cyclopentyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(2-chloranyl-4-methyl-phenyl)ethanamide

Systemtic Name: 2-[3-butyl-7-cyclopentyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(2-chloranyl-4-methyl-phenyl)ethanamide Openeye Name: 2-(3-butyl-7-cyclopentyl-2,6-dioxo-purin-1-yl)-N-(2-chloro-4-methyl-phenyl)acetamide CAS Name: 2-(3-butyl-7-cyclopentyl-2,6-dioxo-1-purinyl)-N-(2-chloro-4-methylphenyl)acetamide IUPAC Name: 2-(3-butyl-7-cyclopentyl-2,6-dioxopurin-1-yl)-N-(2-chloro-4-methylphenyl)acetamide Traditional Name: 2-(3-butyl-7-cyclopentyl-2,6-diketo-purin-1-yl)-N-(2-chloro-4-methyl-phenyl)acetamide Formula: C23H28ClN5O3 MolecularWeight: 457.95312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC3=C(C=C(C=C3)C)Cl)N(C=N2)C4CCCC4

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC3=C(C=C(C=C3)C)Cl)N(C=N2)C4CCCC4

InChI

InChI=1S/C23H28ClN5O3/c1-3-4-11-27-21-20(29(14-25-21)16-7-5-6-8-16)22(31)28(23(27)32)13-19(30)26-18-10-9-15(2)12-17(18)24/h9-10,12,14,16H,3-8,11,13H2,1-2H3,(H,26,30)