(5-methylsulfonyl-2-thiophen-2-yl-phenyl)-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (5-methylsulfonyl-2-thiophen-2-yl-phenyl)-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: [5-methylsulfonyl-2-(2-thienyl)phenyl]-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (5-methylsulfonyl-2-thiophen-2-ylphenyl)-[4-[4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (5-methylsulfonyl-2-thiophen-2-ylphenyl)-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: [5-mesyl-2-(2-thienyl)phenyl]-[4-[4-(trifluoromethyl)phenyl]piperazino]methanone Formula: C23H21F3N2O3S2 MolecularWeight: 494.54965

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)C2=CC=CS2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)C2=CC=CS2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H21F3N2O3S2/c1-33(30,31)18-8-9-19(21-3-2-14-32-21)20(15-18)22(29)28-12-10-27(11-13-28)17-6-4-16(5-7-17)23(24,25)26/h2-9,14-15H,10-13H2,1H3