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

Systemtic Name: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(2-thenyl)piperazine-1,4-diium-1-yl]acetamide Formula: C20H29N3O2S+2 MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CS3

Isomeric SMILES

COC1=CC=CC=C1CCNC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CS3

InChI

InChI=1S/C20H27N3O2S/c1-25-19-7-3-2-5-17(19)8-9-21-20(24)16-23-12-10-22(11-13-23)15-18-6-4-14-26-18/h2-7,14H,8-13,15-16H2,1H3,(H,21,24)/p+2