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

Systemtic Name: 2-[7-(2-chlorophenyl)-2,6-bis(oxidanylidene)-8-piperazin-1-yl-purin-3-yl]ethanamide Openeye Name: 2-[7-(2-chlorophenyl)-2,6-dioxo-8-piperazin-1-yl-purin-3-yl]acetamide CAS Name: 2-[7-(2-chlorophenyl)-2,6-dioxo-8-(1-piperazinyl)-3-purinyl]acetamide IUPAC Name: 2-[7-(2-chlorophenyl)-2,6-dioxo-8-piperazin-1-ylpurin-3-yl]acetamide Traditional Name: 2-[7-(2-chlorophenyl)-2,6-diketo-8-piperazino-purin-3-yl]acetamide Formula: C17H18ClN7O3 MolecularWeight: 403.82292

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(N2C4=CC=CC=C4Cl)C(=O)NC(=O)N3CC(=O)N

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(N2C4=CC=CC=C4Cl)C(=O)NC(=O)N3CC(=O)N

InChI

InChI=1S/C17H18ClN7O3/c18-10-3-1-2-4-11(10)25-13-14(21-16(25)23-7-5-20-6-8-23)24(9-12(19)26)17(28)22-15(13)27/h1-4,20H,5-9H2,(H2,19,26)(H,22,27,28)