2-[7-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-1-yl]-N-(3-ethylphenyl)ethanamide

Systemtic Name: 2-[7-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-1-yl]-N-(3-ethylphenyl)ethanamide Openeye Name: 2-(3-benzyl-7-ethyl-2,6-dioxo-purin-1-yl)-N-(3-ethylphenyl)acetamide CAS Name: 2-[7-ethyl-2,6-dioxo-3-(phenylmethyl)-1-purinyl]-N-(3-ethylphenyl)acetamide IUPAC Name: 2-(3-benzyl-7-ethyl-2,6-dioxopurin-1-yl)-N-(3-ethylphenyl)acetamide Traditional Name: 2-(3-benzyl-7-ethyl-2,6-diketo-purin-1-yl)-N-(3-ethylphenyl)acetamide Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CN2C(=O)C3=C(N=CN3CC)N(C2=O)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CN2C(=O)C3=C(N=CN3CC)N(C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H25N5O3/c1-3-17-11-8-12-19(13-17)26-20(30)15-29-23(31)21-22(25-16-27(21)4-2)28(24(29)32)14-18-9-6-5-7-10-18/h5-13,16H,3-4,14-15H2,1-2H3,(H,26,30)