(5-methylsulfonyl-2-thiophen-3-yl-phenyl)-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (5-methylsulfonyl-2-thiophen-3-yl-phenyl)-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: [5-methylsulfonyl-2-(3-thienyl)phenyl]-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: [5-methylsulfonyl-2-(3-thiophenyl)phenyl]-[4-[4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (5-methylsulfonyl-2-thiophen-3-ylphenyl)-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: [5-mesyl-2-(3-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=CSC=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

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

InChI

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