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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H27FN2O3S2/c24-18-5-11-22(12-6-18)31(28,29)26-15-13-17(14-16-26)23(27)25-19-7-9-21(10-8-19)30-20-3-1-2-4-20/h5-12,17,20H,1-4,13-16H2,(H,25,27)