2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-[(5-chloro-2-thienyl)methylsulfanyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]acetamide CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]-N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]acetamide IUPAC Name: 2-[(5-chlorothiophen-2-yl)methylsulfanyl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]acetamide Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]acetamide Formula: C18H22ClN2OS2+ MolecularWeight: 381.96308

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)CSCC3=CC=C(S3)Cl

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)CSCC3=CC=C(S3)Cl

InChI

InChI=1S/C18H21ClN2OS2/c19-17-8-7-16(24-17)12-23-13-18(22)20-15-5-3-14(4-6-15)11-21-9-1-2-10-21/h3-8H,1-2,9-13H2,(H,20,22)/p+1