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

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butyramide Formula: C22H29ClFN4O3S+ MolecularWeight: 484.007063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClFN4O3S/c1-26-12-14-28(15-13-26)21-10-5-17(23)16-20(21)25-22(29)4-3-11-27(2)32(30,31)19-8-6-18(24)7-9-19/h5-10,16H,3-4,11-15H2,1-2H3,(H,25,29)/p+1