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

Systemtic Name: N-cyclohexyl-2-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]sulfanylacetamide Traditional Name: N-cyclohexyl-2-[[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]thio]acetamide Formula: C19H30N3O3S2+ MolecularWeight: 412.5898

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)SCC(=O)NC3CCCCC3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)SCC(=O)NC3CCCCC3

InChI

InChI=1S/C19H29N3O3S2/c1-21-11-13-22(14-12-21)27(24,25)18-9-7-17(8-10-18)26-15-19(23)20-16-5-3-2-4-6-16/h7-10,16H,2-6,11-15H2,1H3,(H,20,23)/p+1