4-cyano-N-[5-pyrrolidin-1-ylsulfonyl-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]benzamide

Systemtic Name: 4-cyano-N-[5-pyrrolidin-1-ylsulfonyl-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]benzamide Openeye Name: 4-cyano-N-[5-pyrrolidin-1-ylsulfonyl-2-(2,2,2-trifluoroethoxy)phenyl]benzamide CAS Name: 4-cyano-N-[5-(1-pyrrolidinylsulfonyl)-2-(2,2,2-trifluoroethoxy)phenyl]benzamide IUPAC Name: 4-cyano-N-[5-pyrrolidin-1-ylsulfonyl-2-(2,2,2-trifluoroethoxy)phenyl]benzamide Traditional Name: 4-cyano-N-[5-pyrrolidinosulfonyl-2-(2,2,2-trifluoroethoxy)phenyl]benzamide Formula: C20H18F3N3O4S MolecularWeight: 453.43483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(F)(F)F)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(F)(F)F)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H18F3N3O4S/c21-20(22,23)13-30-18-8-7-16(31(28,29)26-9-1-2-10-26)11-17(18)25-19(27)15-5-3-14(12-24)4-6-15/h3-8,11H,1-2,9-10,13H2,(H,25,27)