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

Systemtic Name: 2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[4-(2-thenoyl)piperazin-1-ium-1-yl]acetamide Formula: C20H26N3O2S+ MolecularWeight: 372.50434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O2S/c1-14-11-15(2)19(16(3)12-14)21-18(24)13-22-6-8-23(9-7-22)20(25)17-5-4-10-26-17/h4-5,10-12H,6-9,13H2,1-3H3,(H,21,24)/p+1