N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methylamino]acetamide Traditional Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetamide Formula: C21H27ClFN4O3S+ MolecularWeight: 469.980483

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H26ClFN4O3S/c1-3-26-10-12-27(13-11-26)20-9-4-16(22)14-19(20)24-21(28)15-25(2)31(29,30)18-7-5-17(23)6-8-18/h4-9,14H,3,10-13,15H2,1-2H3,(H,24,28)/p+1