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

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-[(5-chloro-2-thienyl)methylsulfanyl]-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-[(5-chlorothiophen-2-yl)methylsulfanyl]-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C18H23ClN3OS2+ MolecularWeight: 396.97772

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)CSCC3=CC=C(S3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)CSCC3=CC=C(S3)Cl

InChI

InChI=1S/C18H22ClN3OS2/c1-21-8-10-22(11-9-21)16-5-3-2-4-15(16)20-18(23)13-24-12-14-6-7-17(19)25-14/h2-7H,8-13H2,1H3,(H,20,23)/p+1