1-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2-(2-thienyl)ethanone CAS Name: 1-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazino]-2-(2-thienyl)ethanone Formula: C17H16ClF3N2O3S2 MolecularWeight: 452.89875

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC=CS2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC=CS2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C17H16ClF3N2O3S2/c18-15-4-3-13(11-14(15)17(19,20)21)28(25,26)23-7-5-22(6-8-23)16(24)10-12-2-1-9-27-12/h1-4,9,11H,5-8,10H2