2-(4-acetamidophenyl)sulfanyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide Formula: C21H27N4O4S2+ MolecularWeight: 463.59348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C21H26N4O4S2/c1-16(26)22-17-3-7-19(8-4-17)30-15-21(27)23-18-5-9-20(10-6-18)31(28,29)25-13-11-24(2)12-14-25/h3-10H,11-15H2,1-2H3,(H,22,26)(H,23,27)/p+1