2-[3-butyl-7-(furan-2-ylmethyl)-2,6-bis(oxidanylidene)purin-1-yl]-N-(4-ethoxyphenyl)ethanamide

Systemtic Name: 2-[3-butyl-7-(furan-2-ylmethyl)-2,6-bis(oxidanylidene)purin-1-yl]-N-(4-ethoxyphenyl)ethanamide Openeye Name: 2-[3-butyl-7-(2-furylmethyl)-2,6-dioxo-purin-1-yl]-N-(4-ethoxyphenyl)acetamide CAS Name: 2-[3-butyl-7-(2-furanylmethyl)-2,6-dioxo-1-purinyl]-N-(4-ethoxyphenyl)acetamide IUPAC Name: 2-[3-butyl-7-(furan-2-ylmethyl)-2,6-dioxopurin-1-yl]-N-(4-ethoxyphenyl)acetamide Traditional Name: 2-[3-butyl-7-(2-furfuryl)-2,6-diketo-purin-1-yl]-N-p-phenetyl-acetamide Formula: C24H27N5O5 MolecularWeight: 465.50168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC3=CC=C(C=C3)OCC)N(C=N2)CC4=CC=CO4

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC3=CC=C(C=C3)OCC)N(C=N2)CC4=CC=CO4

InChI

InChI=1S/C24H27N5O5/c1-3-5-12-28-22-21(27(16-25-22)14-19-7-6-13-34-19)23(31)29(24(28)32)15-20(30)26-17-8-10-18(11-9-17)33-4-2/h6-11,13,16H,3-5,12,14-15H2,1-2H3,(H,26,30)