2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[4-(2-thenyl)piperazine-1,4-diium-1-yl]acetamide Formula: C20H29N3OS+2 MolecularWeight: 359.52876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CS3)C

InChI

InChI=1S/C20H27N3OS/c1-15-11-16(2)20(17(3)12-15)21-19(24)14-23-8-6-22(7-9-23)13-18-5-4-10-25-18/h4-5,10-12H,6-9,13-14H2,1-3H3,(H,21,24)/p+2