N-(5-tert-butyl-2-methoxy-phenyl)-2-[7-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-1-yl]ethanamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-[7-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-1-yl]ethanamide Openeye Name: 2-(3-benzyl-7-ethyl-2,6-dioxo-purin-1-yl)-N-(5-tert-butyl-2-methoxy-phenyl)acetamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-2-[7-ethyl-2,6-dioxo-3-(phenylmethyl)-1-purinyl]acetamide IUPAC Name: 2-(3-benzyl-7-ethyl-2,6-dioxopurin-1-yl)-N-(5-tert-butyl-2-methoxyphenyl)acetamide Traditional Name: 2-(3-benzyl-7-ethyl-2,6-diketo-purin-1-yl)-N-(5-tert-butyl-2-methoxy-phenyl)acetamide Formula: C27H31N5O4 MolecularWeight: 489.56614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C(=O)N(C(=O)N2CC3=CC=CC=C3)CC(=O)NC4=C(C=CC(=C4)C(C)(C)C)OC

Isomeric SMILES

CCN1C=NC2=C1C(=O)N(C(=O)N2CC3=CC=CC=C3)CC(=O)NC4=C(C=CC(=C4)C(C)(C)C)OC

InChI

InChI=1S/C27H31N5O4/c1-6-30-17-28-24-23(30)25(34)32(26(35)31(24)15-18-10-8-7-9-11-18)16-22(33)29-20-14-19(27(2,3)4)12-13-21(20)36-5/h7-14,17H,6,15-16H2,1-5H3,(H,29,33)