4-[bis(fluoranyl)methylsulfonyl]-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 4-[bis(fluoranyl)methylsulfonyl]-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 4-(difluoromethylsulfonyl)-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 4-(difluoromethylsulfonyl)-N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-(difluoromethylsulfonyl)-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]benzamide Traditional Name: 4-(difluoromethylsulfonyl)-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]benzamide Formula: C18H21F2N2O4S2+ MolecularWeight: 431.497146

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)F)C3=CC=CS3

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)F)C3=CC=CS3

InChI

InChI=1S/C18H20F2N2O4S2/c19-18(20)28(24,25)14-5-3-13(4-6-14)17(23)21-12-15(16-2-1-11-27-16)22-7-9-26-10-8-22/h1-6,11,15,18H,7-10,12H2,(H,21,23)/p+1/t15-/m0/s1