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

Systemtic Name: N-(1-adamantyl)-2-[3-butyl-7-(furan-2-ylmethyl)-2,6-bis(oxidanylidene)purin-1-yl]ethanamide Openeye Name: N-(1-adamantyl)-2-[3-butyl-7-(2-furylmethyl)-2,6-dioxo-purin-1-yl]acetamide CAS Name: N-(1-adamantyl)-2-[3-butyl-7-(2-furanylmethyl)-2,6-dioxo-1-purinyl]acetamide IUPAC Name: N-(1-adamantyl)-2-[3-butyl-7-(furan-2-ylmethyl)-2,6-dioxopurin-1-yl]acetamide Traditional Name: N-(1-adamantyl)-2-[3-butyl-7-(2-furfuryl)-2,6-diketo-purin-1-yl]acetamide Formula: C26H33N5O4 MolecularWeight: 479.57132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC34CC5CC(C3)CC(C5)C4)N(C=N2)CC6=CC=CO6

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC34CC5CC(C3)CC(C5)C4)N(C=N2)CC6=CC=CO6

InChI

InChI=1S/C26H33N5O4/c1-2-3-6-30-23-22(29(16-27-23)14-20-5-4-7-35-20)24(33)31(25(30)34)15-21(32)28-26-11-17-8-18(12-26)10-19(9-17)13-26/h4-5,7,16-19H,2-3,6,8-15H2,1H3,(H,28,32)