2-[(4-chlorophenyl)methylsulfanyl]-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]ethanamide Openeye Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-2-[(4-chlorophenyl)methylsulfanyl]acetamide CAS Name: 2-[(4-chlorophenyl)methylthio]-N-[(3R)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-2-[(4-chlorophenyl)methylsulfanyl]acetamide Traditional Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-2-[(4-chlorobenzyl)thio]acetamide Formula: C20H24ClN2OS+ MolecularWeight: 375.93536

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC(=O)CSCC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@@H]1NC(=O)CSCC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C20H23ClN2OS/c21-18-8-6-17(7-9-18)14-25-15-20(24)22-19-10-11-23(13-19)12-16-4-2-1-3-5-16/h1-9,19H,10-15H2,(H,22,24)/p+1/t19-/m1/s1