2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-[(4-methylphenyl)methyl]-N-propyl-ethanamide

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-[(4-methylphenyl)methyl]-N-propyl-ethanamide Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-propyl-N-(p-tolylmethyl)acetamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-[(4-methylphenyl)methyl]-N-propylacetamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-[(4-methylphenyl)methyl]-N-propylacetamide Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-(4-methylbenzyl)-N-propyl-acetamide Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)C)C(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)C)C(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C

InChI

InChI=1S/C20H25N5O3/c1-5-10-24(11-15-8-6-14(2)7-9-15)16(26)12-25-19(27)17-18(21-13-22(17)3)23(4)20(25)28/h6-9,13H,5,10-12H2,1-4H3