N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-methylsulfonyl-benzamide

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-methylsulfonyl-benzamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-methylsulfonyl-benzamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-methylsulfonylbenzamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-methylsulfonylbenzamide Traditional Name: 2-mesyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C20H26N3O3S+ MolecularWeight: 388.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C20H25N3O3S/c1-15-14-16(23-12-10-22(2)11-13-23)8-9-18(15)21-20(24)17-6-4-5-7-19(17)27(3,25)26/h4-9,14H,10-13H2,1-3H3,(H,21,24)/p+1