4-(phenylsulfamoyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 4-(phenylsulfamoyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 4-(phenylsulfamoyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 4-(phenylsulfamoyl)-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-(phenylsulfamoyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]benzamide Traditional Name: 4-(phenylsulfamoyl)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide Formula: C23H26N3O3S2+ MolecularWeight: 456.60084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H25N3O3S2/c27-23(24-17-21(22-9-6-16-30-22)26-14-4-5-15-26)18-10-12-20(13-11-18)31(28,29)25-19-7-2-1-3-8-19/h1-3,6-13,16,21,25H,4-5,14-15,17H2,(H,24,27)/p+1/t21-/m0/s1