N-(2-cyclopentylsulfanylphenyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-cyclopentylsulfanylphenyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-cyclopentylsulfanylphenyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(cyclopentylthio)phenyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-cyclopentylsulfanylphenyl)-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(cyclopentylthio)phenyl]-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C23H27FN2O3S2 MolecularWeight: 462.600483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CCC(C1)SC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C23H27FN2O3S2/c24-19-9-3-6-12-22(19)31(28,29)26-15-13-17(14-16-26)23(27)25-20-10-4-5-11-21(20)30-18-7-1-2-8-18/h3-6,9-12,17-18H,1-2,7-8,13-16H2,(H,25,27)