2-(4-chlorophenyl)sulfanyl-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]ethanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]acetamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[3-(4-methyl-1-piperazin-4-iumyl)propyl]acetamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]acetamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]acetamide Formula: C16H25ClN3OS+ MolecularWeight: 342.9072

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCNC(=O)CSC2=CC=C(C=C2)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)CCCNC(=O)CSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H24ClN3OS/c1-19-9-11-20(12-10-19)8-2-7-18-16(21)13-22-15-5-3-14(17)4-6-15/h3-6H,2,7-13H2,1H3,(H,18,21)/p+1