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

Systemtic Name: N-(3-chlorophenyl)-2-[7-(2-methoxyethyl)-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-1-yl]ethanamide Openeye Name: 2-[3-benzyl-7-(2-methoxyethyl)-2,6-dioxo-purin-1-yl]-N-(3-chlorophenyl)acetamide CAS Name: N-(3-chlorophenyl)-2-[7-(2-methoxyethyl)-2,6-dioxo-3-(phenylmethyl)-1-purinyl]acetamide IUPAC Name: 2-[3-benzyl-7-(2-methoxyethyl)-2,6-dioxopurin-1-yl]-N-(3-chlorophenyl)acetamide Traditional Name: 2-[3-benzyl-2,6-diketo-7-(2-methoxyethyl)purin-1-yl]-N-(3-chlorophenyl)acetamide Formula: C23H22ClN5O4 MolecularWeight: 467.90488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=NC2=C1C(=O)N(C(=O)N2CC3=CC=CC=C3)CC(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

COCCN1C=NC2=C1C(=O)N(C(=O)N2CC3=CC=CC=C3)CC(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H22ClN5O4/c1-33-11-10-27-15-25-21-20(27)22(31)29(14-19(30)26-18-9-5-8-17(24)12-18)23(32)28(21)13-16-6-3-2-4-7-16/h2-9,12,15H,10-11,13-14H2,1H3,(H,26,30)