4-(4-fluorophenyl)-N-[3-(trifluoromethylsulfanyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-fluorophenyl)-N-[3-(trifluoromethylsulfanyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-(4-fluorophenyl)-N-[3-(trifluoromethylsulfanyl)phenyl]piperazine-1-carboxamide CAS Name: 4-(4-fluorophenyl)-N-[3-(trifluoromethylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-fluorophenyl)-N-[3-(trifluoromethylsulfanyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(4-fluorophenyl)-N-[3-(trifluoromethylthio)phenyl]piperazine-1-carboxamide Formula: C18H17F4N3OS MolecularWeight: 399.405693

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)NC3=CC(=CC=C3)SC(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)NC3=CC(=CC=C3)SC(F)(F)F

InChI

InChI=1S/C18H17F4N3OS/c19-13-4-6-15(7-5-13)24-8-10-25(11-9-24)17(26)23-14-2-1-3-16(12-14)27-18(20,21)22/h1-7,12H,8-11H2,(H,23,26)