N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3,5-bis(fluoranyl)benzenesulfonamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3,5-bis(fluoranyl)benzenesulfonamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3,5-difluoro-benzenesulfonamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3,5-difluorobenzenesulfonamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-3,5-difluorobenzenesulfonamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-3,5-difluoro-benzenesulfonamide Formula: C18H20F2N2O5S2 MolecularWeight: 446.488606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=CC(=C2)F)F)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=CC(=C2)F)F)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H20F2N2O5S2/c1-2-27-17-6-5-15(12-18(17)29(25,26)22-7-3-4-8-22)21-28(23,24)16-10-13(19)9-14(20)11-16/h5-6,9-12,21H,2-4,7-8H2,1H3