N-[4-[7-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-8-yl]phenyl]ethanamide

Systemtic Name: N-[4-[7-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-8-yl]phenyl]ethanamide Openeye Name: N-[4-(3-benzyl-7-ethyl-2,6-dioxo-purin-8-yl)phenyl]acetamide CAS Name: N-[4-[7-ethyl-2,6-dioxo-3-(phenylmethyl)-8-purinyl]phenyl]acetamide IUPAC Name: N-[4-(3-benzyl-7-ethyl-2,6-dioxopurin-8-yl)phenyl]acetamide Traditional Name: N-[4-(3-benzyl-7-ethyl-2,6-diketo-purin-8-yl)phenyl]acetamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1C3=CC=C(C=C3)NC(=O)C)N(C(=O)NC2=O)CC4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(N=C1C3=CC=C(C=C3)NC(=O)C)N(C(=O)NC2=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O3/c1-3-26-18-20(24-19(26)16-9-11-17(12-10-16)23-14(2)28)27(22(30)25-21(18)29)13-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3,(H,23,28)(H,25,29,30)