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

Systemtic Name: 2-[7-(2-chlorophenyl)-1-methyl-2,6-bis(oxidanylidene)-8-piperazin-1-yl-purin-3-yl]ethanamide Openeye Name: 2-[7-(2-chlorophenyl)-1-methyl-2,6-dioxo-8-piperazin-1-yl-purin-3-yl]acetamide CAS Name: 2-[7-(2-chlorophenyl)-1-methyl-2,6-dioxo-8-(1-piperazinyl)-3-purinyl]acetamide IUPAC Name: 2-[7-(2-chlorophenyl)-1-methyl-2,6-dioxo-8-piperazin-1-ylpurin-3-yl]acetamide Traditional Name: 2-[7-(2-chlorophenyl)-2,6-diketo-1-methyl-8-piperazino-purin-3-yl]acetamide Formula: C18H20ClN7O3 MolecularWeight: 417.8495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C(N2C3=CC=CC=C3Cl)N4CCNCC4)N(C1=O)CC(=O)N

Isomeric SMILES

CN1C(=O)C2=C(N=C(N2C3=CC=CC=C3Cl)N4CCNCC4)N(C1=O)CC(=O)N

InChI

InChI=1S/C18H20ClN7O3/c1-23-16(28)14-15(25(18(23)29)10-13(20)27)22-17(24-8-6-21-7-9-24)26(14)12-5-3-2-4-11(12)19/h2-5,21H,6-10H2,1H3,(H2,20,27)