2-[3-[(2-fluorophenyl)methylsulfanyl]indol-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[3-[(2-fluorophenyl)methylsulfanyl]indol-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[3-[(2-fluorophenyl)methylsulfanyl]indol-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[3-[(2-fluorophenyl)methylthio]-1-indolyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[3-[(2-fluorophenyl)methylsulfanyl]indol-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[3-[(2-fluorobenzyl)thio]indol-1-yl]-1-pyrrolidino-ethanone Formula: C21H21FN2OS MolecularWeight: 368.467643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C=C(C3=CC=CC=C32)SCC4=CC=CC=C4F

Isomeric SMILES

C1CCN(C1)C(=O)CN2C=C(C3=CC=CC=C32)SCC4=CC=CC=C4F

InChI

InChI=1S/C21H21FN2OS/c22-18-9-3-1-7-16(18)15-26-20-13-24(19-10-4-2-8-17(19)20)14-21(25)23-11-5-6-12-23/h1-4,7-10,13H,5-6,11-12,14-15H2