1-[4-(8-ethyl-7H-purin-6-yl)piperazin-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[4-(8-ethyl-7H-purin-6-yl)piperazin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[4-(8-ethyl-7H-purin-6-yl)piperazin-1-yl]-2-phenyl-ethanone CAS Name: 1-[4-(8-ethyl-7H-purin-6-yl)-1-piperazinyl]-2-phenylethanone IUPAC Name: 1-[4-(8-ethyl-7H-purin-6-yl)piperazin-1-yl]-2-phenylethanone Traditional Name: 1-[4-(8-ethyl-7H-purin-6-yl)piperazino]-2-phenyl-ethanone Formula: C19H22N6O MolecularWeight: 350.41758

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1)C(=NC=N2)N3CCN(CC3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CCC1=NC2=C(N1)C(=NC=N2)N3CCN(CC3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C19H22N6O/c1-2-15-22-17-18(23-15)20-13-21-19(17)25-10-8-24(9-11-25)16(26)12-14-6-4-3-5-7-14/h3-7,13H,2,8-12H2,1H3,(H,20,21,22,23)