N-[3,5-bis(fluoranyl)phenyl]-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[3,5-bis(fluoranyl)phenyl]-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3,5-difluorophenyl)-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-(3,5-difluorophenyl)-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(3,5-difluorophenyl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(3,5-difluorophenyl)-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]acetamide Formula: C17H17F2N3O3S2 MolecularWeight: 413.461986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC(=CC(=C3)F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC(=CC(=C3)F)F

InChI

InChI=1S/C17H17F2N3O3S2/c18-12-7-13(19)9-14(8-12)21-16(23)11-26-17-4-3-15(10-20-17)27(24,25)22-5-1-2-6-22/h3-4,7-10H,1-2,5-6,11H2,(H,21,23)