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

Systemtic Name: N-[3-[2,6-bis(oxidanylidene)-1-(phenylmethyl)-7H-purin-3-yl]phenyl]ethanamide Openeye Name: N-[3-(1-benzyl-2,6-dioxo-7H-purin-3-yl)phenyl]acetamide CAS Name: N-[3-[2,6-dioxo-1-(phenylmethyl)-7H-purin-3-yl]phenyl]acetamide IUPAC Name: N-[3-(1-benzyl-2,6-dioxo-7H-purin-3-yl)phenyl]acetamide Traditional Name: N-[3-(1-benzyl-2,6-diketo-7H-purin-3-yl)phenyl]acetamide Formula: C20H17N5O3 MolecularWeight: 375.38068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)N2C3=C(C(=O)N(C2=O)CC4=CC=CC=C4)NC=N3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)N2C3=C(C(=O)N(C2=O)CC4=CC=CC=C4)NC=N3

InChI

InChI=1S/C20H17N5O3/c1-13(26)23-15-8-5-9-16(10-15)25-18-17(21-12-22-18)19(27)24(20(25)28)11-14-6-3-2-4-7-14/h2-10,12H,11H2,1H3,(H,21,22)(H,23,26)