N-[(4-fluorophenyl)methyl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanamide Traditional Name: N-(4-fluorobenzyl)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]propionamide Formula: C20H24FN3O3S2 MolecularWeight: 437.551263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)F)SC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)F)SC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H24FN3O3S2/c1-15(20(25)23-13-16-5-7-17(21)8-6-16)28-19-10-9-18(14-22-19)29(26,27)24-11-3-2-4-12-24/h5-10,14-15H,2-4,11-13H2,1H3,(H,23,25)