2-[4-[3-methyl-7-(naphthalen-1-ylmethyl)-2,6-bis(oxidanylidene)purin-8-yl]piperazin-1-yl]ethanamide

Systemtic Name: 2-[4-[3-methyl-7-(naphthalen-1-ylmethyl)-2,6-bis(oxidanylidene)purin-8-yl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[3-methyl-7-(1-naphthylmethyl)-2,6-dioxo-purin-8-yl]piperazin-1-yl]acetamide CAS Name: 2-[4-[3-methyl-7-(1-naphthalenylmethyl)-2,6-dioxo-8-purinyl]-1-piperazinyl]acetamide IUPAC Name: 2-[4-[3-methyl-7-(naphthalen-1-ylmethyl)-2,6-dioxopurin-8-yl]piperazin-1-yl]acetamide Traditional Name: 2-[4-[2,6-diketo-3-methyl-7-(1-naphthylmethyl)purin-8-yl]piperazino]acetamide Formula: C23H25N7O3 MolecularWeight: 447.4897

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)CC(=O)N)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)CC(=O)N)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H25N7O3/c1-27-20-19(21(32)26-23(27)33)30(13-16-7-4-6-15-5-2-3-8-17(15)16)22(25-20)29-11-9-28(10-12-29)14-18(24)31/h2-8H,9-14H2,1H3,(H2,24,31)(H,26,32,33)