1-pyrrolidin-1-yl-2-[3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]indol-1-yl]ethanone

Systemtic Name: 1-pyrrolidin-1-yl-2-[3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]indol-1-yl]ethanone Openeye Name: 1-pyrrolidin-1-yl-2-[3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]indol-1-yl]ethanone CAS Name: 1-(1-pyrrolidinyl)-2-[3-[[4-(trifluoromethyl)phenyl]methylthio]-1-indolyl]ethanone IUPAC Name: 1-pyrrolidin-1-yl-2-[3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]indol-1-yl]ethanone Traditional Name: 1-pyrrolidino-2-[3-[[4-(trifluoromethyl)benzyl]thio]indol-1-yl]ethanone Formula: C22H21F3N2OS MolecularWeight: 418.47515

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C=C(C3=CC=CC=C32)SCC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CCN(C1)C(=O)CN2C=C(C3=CC=CC=C32)SCC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H21F3N2OS/c23-22(24,25)17-9-7-16(8-10-17)15-29-20-13-27(19-6-2-1-5-18(19)20)14-21(28)26-11-3-4-12-26/h1-2,5-10,13H,3-4,11-12,14-15H2