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

Systemtic Name: 1-[4-[2-(4-chlorophenyl)sulfanylpyridin-3-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[2-(4-chlorophenyl)sulfanylpyridine-3-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[2-[(4-chlorophenyl)thio]-3-pyridinyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[2-(4-chlorophenyl)sulfanylpyridine-3-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[2-[(4-chlorophenyl)thio]nicotinoyl]piperazino]ethanone Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O2S/c1-13(23)21-9-11-22(12-10-21)18(24)16-3-2-8-20-17(16)25-15-6-4-14(19)5-7-15/h2-8H,9-12H2,1H3