N-(3-methylsulfonylphenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-methylsulfonylphenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-methylsulfonylphenyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(3-methylsulfonylphenyl)-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(3-methylsulfonylphenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(3-mesylphenyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C17H21N2O3S2+ MolecularWeight: 365.49024

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C[NH+]2CCCC2C3=CC=CS3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C[NH+]2CCC[C@@H]2C3=CC=CS3

InChI

InChI=1S/C17H20N2O3S2/c1-24(21,22)14-6-2-5-13(11-14)18-17(20)12-19-9-3-7-15(19)16-8-4-10-23-16/h2,4-6,8,10-11,15H,3,7,9,12H2,1H3,(H,18,20)/p+1/t15-/m1/s1