2-[1,3-dimethyl-8-[(4-methylphenyl)methylamino]-2,6-bis(oxidanylidene)purin-7-yl]ethanamide

Systemtic Name: 2-[1,3-dimethyl-8-[(4-methylphenyl)methylamino]-2,6-bis(oxidanylidene)purin-7-yl]ethanamide Openeye Name: 2-[1,3-dimethyl-2,6-dioxo-8-(p-tolylmethylamino)purin-7-yl]acetamide CAS Name: 2-[1,3-dimethyl-8-[(4-methylphenyl)methylamino]-2,6-dioxo-7-purinyl]acetamide IUPAC Name: 2-[1,3-dimethyl-8-[(4-methylphenyl)methylamino]-2,6-dioxopurin-7-yl]acetamide Traditional Name: 2-[2,6-diketo-1,3-dimethyl-8-[(4-methylbenzyl)amino]purin-7-yl]acetamide Formula: C17H20N6O3 MolecularWeight: 356.3791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC3=C(N2CC(=O)N)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC3=C(N2CC(=O)N)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H20N6O3/c1-10-4-6-11(7-5-10)8-19-16-20-14-13(23(16)9-12(18)24)15(25)22(3)17(26)21(14)2/h4-7H,8-9H2,1-3H3,(H2,18,24)(H,19,20)