2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]-1-[4-(2-naphthylsulfonyl)piperazino]ethanone Formula: C22H19ClF3N3O3S2 MolecularWeight: 529.98277

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=C(C=C(C=N2)C(F)(F)F)Cl)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=C(C=C(C=N2)C(F)(F)F)Cl)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H19ClF3N3O3S2/c23-19-12-17(22(24,25)26)13-27-21(19)33-14-20(30)28-7-9-29(10-8-28)34(31,32)18-6-5-15-3-1-2-4-16(15)11-18/h1-6,11-13H,7-10,14H2