2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-[2,3,4-tris(fluoranyl)phenyl]propanamide

Systemtic Name: 2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-[2,3,4-tris(fluoranyl)phenyl]propanamide Openeye Name: 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]-N-(2,3,4-trifluorophenyl)propanamide CAS Name: 2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]-N-(2,3,4-trifluorophenyl)propanamide IUPAC Name: 2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-(2,3,4-trifluorophenyl)propanamide Traditional Name: 2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]-N-(2,3,4-trifluorophenyl)propionamide Formula: C18H18F3N3O3S2 MolecularWeight: 445.47903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C(=C(C=C1)F)F)F)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C(=O)NC1=C(C(=C(C=C1)F)F)F)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H18F3N3O3S2/c1-11(18(25)23-14-6-5-13(19)16(20)17(14)21)28-15-7-4-12(10-22-15)29(26,27)24-8-2-3-9-24/h4-7,10-11H,2-3,8-9H2,1H3,(H,23,25)