3-[8-cyclopentyl-2,6-bis(oxidanylidene)-7-(phenylmethyl)-1-propyl-purin-3-yl]-N-methyl-propanamide

Systemtic Name: 3-[8-cyclopentyl-2,6-bis(oxidanylidene)-7-(phenylmethyl)-1-propyl-purin-3-yl]-N-methyl-propanamide Openeye Name: 3-(7-benzyl-8-cyclopentyl-2,6-dioxo-1-propyl-purin-3-yl)-N-methyl-propanamide CAS Name: 3-[8-cyclopentyl-2,6-dioxo-7-(phenylmethyl)-1-propyl-3-purinyl]-N-methylpropanamide IUPAC Name: 3-(7-benzyl-8-cyclopentyl-2,6-dioxo-1-propylpurin-3-yl)-N-methylpropanamide Traditional Name: 3-(7-benzyl-8-cyclopentyl-2,6-diketo-1-propyl-purin-3-yl)-N-methyl-propionamide Formula: C24H31N5O3 MolecularWeight: 437.53464

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2CC3=CC=CC=C3)C4CCCC4)N(C1=O)CCC(=O)NC

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2CC3=CC=CC=C3)C4CCCC4)N(C1=O)CCC(=O)NC

InChI

InChI=1S/C24H31N5O3/c1-3-14-28-23(31)20-22(27(24(28)32)15-13-19(30)25-2)26-21(18-11-7-8-12-18)29(20)16-17-9-5-4-6-10-17/h4-6,9-10,18H,3,7-8,11-16H2,1-2H3,(H,25,30)