4-(1,3-dithiolan-2-yl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-(1,3-dithiolan-2-yl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 4-(1,3-dithiolan-2-yl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-(1,3-dithiolan-2-yl)-N-[2-pyrrolidino-5-(trifluoromethyl)phenyl]benzamide Formula: C21H21F3N2OS2 MolecularWeight: 438.52945

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C21H21F3N2OS2/c22-21(23,24)16-7-8-18(26-9-1-2-10-26)17(13-16)25-19(27)14-3-5-15(6-4-14)20-28-11-12-29-20/h3-8,13,20H,1-2,9-12H2,(H,25,27)