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

Systemtic Name: 4-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 4-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 4-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]benzamide Traditional Name: 4-[ethyl(phenyl)sulfamoyl]-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide Formula: C25H30N3O3S2+ MolecularWeight: 484.654

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(C3=CC=CS3)[NH+]4CCCC4

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC[C@@H](C3=CC=CS3)[NH+]4CCCC4

InChI

InChI=1S/C25H29N3O3S2/c1-2-28(21-9-4-3-5-10-21)33(30,31)22-14-12-20(13-15-22)25(29)26-19-23(24-11-8-18-32-24)27-16-6-7-17-27/h3-5,8-15,18,23H,2,6-7,16-17,19H2,1H3,(H,26,29)/p+1/t23-/m0/s1