3-[(2,5-dimethylphenyl)sulfonylamino]-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Openeye Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide CAS Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Traditional Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]propionamide Formula: C23H33N4O3S+ MolecularWeight: 445.59812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NC2=C(C=C(C=C2)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NC2=C(C=C(C=C2)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C23H32N4O3S/c1-17-5-6-18(2)22(15-17)31(29,30)24-10-9-23(28)25-21-8-7-20(16-19(21)3)27-13-11-26(4)12-14-27/h5-8,15-16,24H,9-14H2,1-4H3,(H,25,28)/p+1