N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-piperidinosulfonyl-benzamide Formula: C24H33N4O3S+ MolecularWeight: 457.60882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H32N4O3S/c1-19-17-21(27-15-13-26(2)14-16-27)9-10-23(19)25-24(29)20-7-6-8-22(18-20)32(30,31)28-11-4-3-5-12-28/h6-10,17-18H,3-5,11-16H2,1-2H3,(H,25,29)/p+1