1-[3-(pyrrolidin-1-ylmethyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[3-(pyrrolidin-1-ylmethyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[3-(pyrrolidin-1-ylmethyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl]-2-(2-thienyl)ethanone CAS Name: 1-[3-(1-pyrrolidinylmethyl)-4-[3-(trifluoromethyl)phenyl]-1-pyrrolidinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[3-(pyrrolidin-1-ylmethyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[3-(pyrrolidinomethyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidino]-2-(2-thienyl)ethanone Formula: C22H25F3N2OS MolecularWeight: 422.50691

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2CN(CC2C3=CC(=CC=C3)C(F)(F)F)C(=O)CC4=CC=CS4

Isomeric SMILES

C1CCN(C1)CC2CN(CC2C3=CC(=CC=C3)C(F)(F)F)C(=O)CC4=CC=CS4

InChI

InChI=1S/C22H25F3N2OS/c23-22(24,25)18-6-3-5-16(11-18)20-15-27(21(28)12-19-7-4-10-29-19)14-17(20)13-26-8-1-2-9-26/h3-7,10-11,17,20H,1-2,8-9,12-15H2