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

Systemtic Name: 4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]butanamide Openeye Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]butanamide CAS Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]butanamide IUPAC Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]butanamide Traditional Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]butyramide Formula: C24H33N4O4S+ MolecularWeight: 473.60822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NC2=CC=CC=C2N3CC[NH+](CC3)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NC2=CC=CC=C2N3CC[NH+](CC3)C

InChI

InChI=1S/C24H32N4O4S/c1-19(29)20-10-12-21(13-11-20)33(31,32)27(3)14-6-9-24(30)25-22-7-4-5-8-23(22)28-17-15-26(2)16-18-28/h4-5,7-8,10-13H,6,9,14-18H2,1-3H3,(H,25,30)/p+1