3-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]-N-(5-cyanopentyl)cyclopentane-1-carboxamide

Systemtic Name: 3-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]-N-(5-cyanopentyl)cyclopentane-1-carboxamide Openeye Name: N-(5-cyanopentyl)-3-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)cyclopentanecarboxamide CAS Name: N-(5-cyanopentyl)-3-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)-1-cyclopentanecarboxamide IUPAC Name: N-(5-cyanopentyl)-3-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)cyclopentane-1-carboxamide Traditional Name: N-(5-cyanopentyl)-3-(2,6-diketo-1,3-dipropyl-7H-purin-8-yl)cyclopentanecarboxamide Formula: C23H34N6O3 MolecularWeight: 442.55446

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3CCC(C3)C(=O)NCCCCCC#N

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3CCC(C3)C(=O)NCCCCCC#N

InChI

InChI=1S/C23H34N6O3/c1-3-13-28-20-18(22(31)29(14-4-2)23(28)32)26-19(27-20)16-9-10-17(15-16)21(30)25-12-8-6-5-7-11-24/h16-17H,3-10,12-15H2,1-2H3,(H,25,30)(H,26,27)