2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C19H26N3O3S2+ MolecularWeight: 408.55804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C19H25N3O3S2/c1-14-11-15(2)19(16(3)12-14)20-17(23)13-21-6-8-22(9-7-21)27(24,25)18-5-4-10-26-18/h4-5,10-12H,6-9,13H2,1-3H3,(H,20,23)/p+1