N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(1,3-dithiolan-2-yl)benzamide

Systemtic Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(1,3-dithiolan-2-yl)benzamide Openeye Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(1,3-dithiolan-2-yl)benzamide CAS Name: N-[(2R)-2-(2-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-(1,3-dithiolan-2-yl)benzamide IUPAC Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-(1,3-dithiolan-2-yl)benzamide Traditional Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(1,3-dithiolan-2-yl)benzamide Formula: C22H26ClN2OS2+ MolecularWeight: 434.03764

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC=C(C=C2)C3SCCS3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CC=C(C=C2)C3SCCS3)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H25ClN2OS2/c23-19-6-2-1-5-18(19)20(25-11-3-4-12-25)15-24-21(26)16-7-9-17(10-8-16)22-27-13-14-28-22/h1-2,5-10,20,22H,3-4,11-15H2,(H,24,26)/p+1/t20-/m0/s1