N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-1-(3-phenylpropylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-1-(3-phenylpropylsulfonyl)nipecotamide Formula: C24H31FN2O3S2 MolecularWeight: 478.642943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NCCSCC3=CC=CC=C3F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NCCSCC3=CC=CC=C3F

InChI

InChI=1S/C24H31FN2O3S2/c25-23-13-5-4-11-22(23)19-31-16-14-26-24(28)21-12-6-15-27(18-21)32(29,30)17-7-10-20-8-2-1-3-9-20/h1-5,8-9,11,13,21H,6-7,10,12,14-19H2,(H,26,28)