2-[7-cyclopentyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-1-yl]-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[7-cyclopentyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-1-yl]-N-(3-methylbutyl)ethanamide Openeye Name: 2-(3-benzyl-7-cyclopentyl-2,6-dioxo-purin-1-yl)-N-isopentyl-acetamide CAS Name: 2-[7-cyclopentyl-2,6-dioxo-3-(phenylmethyl)-1-purinyl]-N-(3-methylbutyl)acetamide IUPAC Name: 2-(3-benzyl-7-cyclopentyl-2,6-dioxopurin-1-yl)-N-(3-methylbutyl)acetamide Traditional Name: 2-(3-benzyl-7-cyclopentyl-2,6-diketo-purin-1-yl)-N-isoamyl-acetamide Formula: C24H31N5O3 MolecularWeight: 437.53464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CN1C(=O)C2=C(N=CN2C3CCCC3)N(C1=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)CCNC(=O)CN1C(=O)C2=C(N=CN2C3CCCC3)N(C1=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H31N5O3/c1-17(2)12-13-25-20(30)15-28-23(31)21-22(26-16-29(21)19-10-6-7-11-19)27(24(28)32)14-18-8-4-3-5-9-18/h3-5,8-9,16-17,19H,6-7,10-15H2,1-2H3,(H,25,30)