N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-4-(trifluoromethylsulfanyl)benzamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-4-(trifluoromethylsulfanyl)benzamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-4-(trifluoromethylsulfanyl)benzamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-4-(trifluoromethylthio)benzamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-4-(trifluoromethylsulfanyl)benzamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-4-(trifluoromethylthio)benzamide Formula: C20H21F3N2O4S2 MolecularWeight: 474.51695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21F3N2O4S2/c1-2-29-17-10-7-15(13-18(17)31(27,28)25-11-3-4-12-25)24-19(26)14-5-8-16(9-6-14)30-20(21,22)23/h5-10,13H,2-4,11-12H2,1H3,(H,24,26)