2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(3-ethanoylphenyl)ethanamide

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(3-ethanoylphenyl)ethanamide Openeye Name: N-(3-acetylphenyl)-2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)acetamide CAS Name: N-(3-acetylphenyl)-2-(3,7-dimethyl-2,6-dioxo-1-purinyl)acetamide IUPAC Name: N-(3-acetylphenyl)-2-(3,7-dimethyl-2,6-dioxopurin-1-yl)acetamide Traditional Name: N-(3-acetylphenyl)-2-(2,6-diketo-3,7-dimethyl-purin-1-yl)acetamide Formula: C17H17N5O4 MolecularWeight: 355.34798

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C

InChI

InChI=1S/C17H17N5O4/c1-10(23)11-5-4-6-12(7-11)19-13(24)8-22-16(25)14-15(18-9-20(14)2)21(3)17(22)26/h4-7,9H,8H2,1-3H3,(H,19,24)