N-[2-(4-chlorophenyl)sulfanylphenyl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C18H20ClN2OS+ MolecularWeight: 347.8822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC[NH+](C1)CC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN2OS/c19-14-7-9-15(10-8-14)23-17-6-2-1-5-16(17)20-18(22)13-21-11-3-4-12-21/h1-2,5-10H,3-4,11-13H2,(H,20,22)/p+1