1-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2-thiophen-3-yl-ethanone

Systemtic Name: 1-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2-thiophen-3-yl-ethanone Openeye Name: 1-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2-(3-thienyl)ethanone CAS Name: 1-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-2-(3-thiophenyl)ethanone IUPAC Name: 1-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2-thiophen-3-ylethanone Traditional Name: 1-[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazino]-2-(3-thienyl)ethanone Formula: C18H16F6N2O3S2 MolecularWeight: 486.451659

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CSC=C2)S(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CSC=C2)S(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H16F6N2O3S2/c19-17(20,21)13-8-14(18(22,23)24)10-15(9-13)31(28,29)26-4-2-25(3-5-26)16(27)7-12-1-6-30-11-12/h1,6,8-11H,2-5,7H2