2-[3-butyl-7-(furan-2-ylmethyl)-2,6-bis(oxidanylidene)purin-1-yl]-N-naphthalen-2-yl-ethanamide

Systemtic Name: 2-[3-butyl-7-(furan-2-ylmethyl)-2,6-bis(oxidanylidene)purin-1-yl]-N-naphthalen-2-yl-ethanamide Openeye Name: 2-[3-butyl-7-(2-furylmethyl)-2,6-dioxo-purin-1-yl]-N-(2-naphthyl)acetamide CAS Name: 2-[3-butyl-7-(2-furanylmethyl)-2,6-dioxo-1-purinyl]-N-(2-naphthalenyl)acetamide IUPAC Name: 2-[3-butyl-7-(furan-2-ylmethyl)-2,6-dioxopurin-1-yl]-N-naphthalen-2-ylacetamide Traditional Name: 2-[3-butyl-7-(2-furfuryl)-2,6-diketo-purin-1-yl]-N-(2-naphthyl)acetamide Formula: C26H25N5O4 MolecularWeight: 471.5078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC3=CC4=CC=CC=C4C=C3)N(C=N2)CC5=CC=CO5

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC3=CC4=CC=CC=C4C=C3)N(C=N2)CC5=CC=CO5

InChI

InChI=1S/C26H25N5O4/c1-2-3-12-30-24-23(29(17-27-24)15-21-9-6-13-35-21)25(33)31(26(30)34)16-22(32)28-20-11-10-18-7-4-5-8-19(18)14-20/h4-11,13-14,17H,2-3,12,15-16H2,1H3,(H,28,32)