2-[2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanoylamino]benzamide

Systemtic Name: 2-[2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanoylamino]benzamide Openeye Name: 2-[[2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetyl]amino]benzamide CAS Name: 2-[[2-(4-methylsulfonyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetyl]amino]benzamide Traditional Name: 2-[[2-(4-mesylpiperazin-1-ium-1-yl)acetyl]amino]benzamide Formula: C14H21N4O4S+ MolecularWeight: 341.40594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)N

Isomeric SMILES

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)N

InChI

InChI=1S/C14H20N4O4S/c1-23(21,22)18-8-6-17(7-9-18)10-13(19)16-12-5-3-2-4-11(12)14(15)20/h2-5H,6-10H2,1H3,(H2,15,20)(H,16,19)/p+1