2-[4-[(4-cyanophenyl)methyl]piperazine-1,4-diium-1-yl]-N-ethyl-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-[(4-cyanophenyl)methyl]piperazine-1,4-diium-1-yl]-N-ethyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[4-[(4-cyanophenyl)methyl]piperazine-1,4-diium-1-yl]-N-ethyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[4-[(4-cyanophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-ethyl-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[4-[(4-cyanophenyl)methyl]piperazine-1,4-diium-1-yl]-N-ethyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[4-(4-cyanobenzyl)piperazine-1,4-diium-1-yl]-N-ethyl-N-(2-thenyl)acetamide Formula: C21H28N4OS+2 MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CS1)C(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCN(CC1=CC=CS1)C(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H26N4OS/c1-2-25(16-20-4-3-13-27-20)21(26)17-24-11-9-23(10-12-24)15-19-7-5-18(14-22)6-8-19/h3-8,13H,2,9-12,15-17H2,1H3/p+2