N-ethyl-N-[(3-fluorophenyl)methyl]-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-ethyl-N-[(3-fluorophenyl)methyl]-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-ethyl-N-[(3-fluorophenyl)methyl]-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-ethyl-N-[(3-fluorophenyl)methyl]-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-ethyl-N-(3-fluorobenzyl)-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]acetamide Formula: C20H24FN3O3S2 MolecularWeight: 437.551263

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)F)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCN(CC1=CC(=CC=C1)F)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

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