2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]ethanamide

Systemtic Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]ethanamide Openeye Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]acetamide CAS Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]acetamide IUPAC Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]acetamide Traditional Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]acetamide Formula: C19H25ClN3O3S2+ MolecularWeight: 443.0031

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC(C1=CC=CS1)[NH+]2CCCC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(CC(=O)NC[C@@H](C1=CC=CS1)[NH+]2CCCC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H24ClN3O3S2/c1-22(28(25,26)16-8-6-15(20)7-9-16)14-19(24)21-13-17(18-5-4-12-27-18)23-10-2-3-11-23/h4-9,12,17H,2-3,10-11,13-14H2,1H3,(H,21,24)/p+1/t17-/m0/s1