N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C24H33N4O4S+ MolecularWeight: 473.60822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3C)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3C)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C24H32N4O4S/c1-19-5-3-4-6-22(19)27-11-9-26(10-12-27)18-24(29)25-21-8-7-20(2)23(17-21)33(30,31)28-13-15-32-16-14-28/h3-8,17H,9-16,18H2,1-2H3,(H,25,29)/p+1