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

Systemtic Name: 2-[2,6-bis(oxidanylidene)-3,7-bis(phenylmethyl)purin-1-yl]-N-ethyl-ethanamide Openeye Name: 2-(3,7-dibenzyl-2,6-dioxo-purin-1-yl)-N-ethyl-acetamide CAS Name: 2-[2,6-dioxo-3,7-bis(phenylmethyl)-1-purinyl]-N-ethylacetamide IUPAC Name: 2-(3,7-dibenzyl-2,6-dioxopurin-1-yl)-N-ethylacetamide Traditional Name: 2-(3,7-dibenzyl-2,6-diketo-purin-1-yl)-N-ethyl-acetamide Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CN1C(=O)C2=C(N=CN2CC3=CC=CC=C3)N(C1=O)CC4=CC=CC=C4

Isomeric SMILES

CCNC(=O)CN1C(=O)C2=C(N=CN2CC3=CC=CC=C3)N(C1=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H23N5O3/c1-2-24-19(29)15-28-22(30)20-21(25-16-26(20)13-17-9-5-3-6-10-17)27(23(28)31)14-18-11-7-4-8-12-18/h3-12,16H,2,13-15H2,1H3,(H,24,29)