N-[(4-fluorophenyl)methyl]-3-[1-(2-pyridin-2-ylsulfanylethanoyl)piperidin-4-yl]propanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-3-[1-(2-pyridin-2-ylsulfanylethanoyl)piperidin-4-yl]propanamide Openeye Name: N-[(4-fluorophenyl)methyl]-3-[1-[2-(2-pyridylsulfanyl)acetyl]-4-piperidyl]propanamide CAS Name: N-[(4-fluorophenyl)methyl]-3-[1-[1-oxo-2-(2-pyridinylthio)ethyl]-4-piperidinyl]propanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-3-[1-(2-pyridin-2-ylsulfanylacetyl)piperidin-4-yl]propanamide Traditional Name: N-(4-fluorobenzyl)-3-[1-[2-(2-pyridylthio)acetyl]-4-piperidyl]propionamide Formula: C22H26FN3O2S MolecularWeight: 415.524143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)NCC2=CC=C(C=C2)F)C(=O)CSC3=CC=CC=N3

Isomeric SMILES

C1CN(CCC1CCC(=O)NCC2=CC=C(C=C2)F)C(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C22H26FN3O2S/c23-19-7-4-18(5-8-19)15-25-20(27)9-6-17-10-13-26(14-11-17)22(28)16-29-21-3-1-2-12-24-21/h1-5,7-8,12,17H,6,9-11,13-16H2,(H,25,27)