N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-(trifluoromethylsulfanyl)benzamide

Systemtic Name: N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-(trifluoromethylsulfanyl)benzamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-(trifluoromethylsulfanyl)benzamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-4-(trifluoromethylthio)benzamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-4-(trifluoromethylsulfanyl)benzamide Traditional Name: N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-4-(trifluoromethylthio)benzamide Formula: C18H17F3N2O4S2 MolecularWeight: 446.46379

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17F3N2O4S2/c19-18(20,21)28-13-5-3-12(4-6-13)17(25)22-15-11-14(7-8-16(15)24)29(26,27)23-9-1-2-10-23/h3-8,11,24H,1-2,9-10H2,(H,22,25)