2-[3-butyl-7-(2-methoxyethyl)-2,6-bis(oxidanylidene)purin-1-yl]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[3-butyl-7-(2-methoxyethyl)-2,6-bis(oxidanylidene)purin-1-yl]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[3-butyl-7-(2-methoxyethyl)-2,6-dioxo-purin-1-yl]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[3-butyl-7-(2-methoxyethyl)-2,6-dioxo-1-purinyl]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[3-butyl-7-(2-methoxyethyl)-2,6-dioxopurin-1-yl]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[3-butyl-2,6-diketo-7-(2-methoxyethyl)purin-1-yl]-N-(2-methoxyphenyl)acetamide Formula: C21H27N5O5 MolecularWeight: 429.46958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC3=CC=CC=C3OC)N(C=N2)CCOC

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)NC3=CC=CC=C3OC)N(C=N2)CCOC

InChI

InChI=1S/C21H27N5O5/c1-4-5-10-25-19-18(24(14-22-19)11-12-30-2)20(28)26(21(25)29)13-17(27)23-15-8-6-7-9-16(15)31-3/h6-9,14H,4-5,10-13H2,1-3H3,(H,23,27)