1-[4-(2-phenylsulfanylpyridin-3-yl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-(2-phenylsulfanylpyridin-3-yl)carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(2-phenylsulfanylpyridine-3-carbonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-[oxo-[2-(phenylthio)-3-pyridinyl]methyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-(2-phenylsulfanylpyridine-3-carbonyl)piperazin-1-yl]ethanone Traditional Name: 1-[4-[2-(phenylthio)nicotinoyl]piperazino]ethanone Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C18H19N3O2S/c1-14(22)20-10-12-21(13-11-20)18(23)16-8-5-9-19-17(16)24-15-6-3-2-4-7-15/h2-9H,10-13H2,1H3