N-(2,5-dimethylphenyl)-2-[3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-(3-methyl-2,6-dioxo-purin-7-yl)acetamide CAS Name: N-(2,5-dimethylphenyl)-2-(3-methyl-2,6-dioxo-7-purinyl)acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(3-methyl-2,6-dioxopurin-7-yl)acetamide Traditional Name: 2-(2,6-diketo-3-methyl-purin-7-yl)-N-(2,5-dimethylphenyl)acetamide Formula: C16H17N5O3 MolecularWeight: 327.33788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CN2C=NC3=C2C(=O)NC(=O)N3C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CN2C=NC3=C2C(=O)NC(=O)N3C

InChI

InChI=1S/C16H17N5O3/c1-9-4-5-10(2)11(6-9)18-12(22)7-21-8-17-14-13(21)15(23)19-16(24)20(14)3/h4-6,8H,7H2,1-3H3,(H,18,22)(H,19,23,24)