4-(2-phenyl-2-phenylsulfanyl-ethanoyl)piperazin-2-one

Systemtic Name: 4-(2-phenyl-2-phenylsulfanyl-ethanoyl)piperazin-2-one Openeye Name: 4-(2-phenyl-2-phenylsulfanyl-acetyl)piperazin-2-one CAS Name: 4-[1-oxo-2-phenyl-2-(phenylthio)ethyl]-2-piperazinone IUPAC Name: 4-(2-phenyl-2-phenylsulfanylacetyl)piperazin-2-one Traditional Name: 4-[2-phenyl-2-(phenylthio)acetyl]piperazin-2-one Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

C1CN(CC(=O)N1)C(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O2S/c21-16-13-20(12-11-19-16)18(22)17(14-7-3-1-4-8-14)23-15-9-5-2-6-10-15/h1-10,17H,11-13H2,(H,19,21)