2-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[4-[(5-bromo-2-thienyl)methyl]piperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[4-[(5-bromo-2-thiophenyl)methyl]-1-piperazin-1-iumyl]-N-[(2-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-[(5-bromothiophen-2-yl)methyl]piperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[4-[(5-bromo-2-thienyl)methyl]piperazin-1-ium-1-yl]-N-(2-fluorobenzyl)-N-methyl-acetamide Formula: C19H24BrFN3OS+ MolecularWeight: 441.380763

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1F)C(=O)C[NH+]2CCN(CC2)CC3=CC=C(S3)Br

Isomeric SMILES

CN(CC1=CC=CC=C1F)C(=O)C[NH+]2CCN(CC2)CC3=CC=C(S3)Br

InChI

InChI=1S/C19H23BrFN3OS/c1-22(12-15-4-2-3-5-17(15)21)19(25)14-24-10-8-23(9-11-24)13-16-6-7-18(20)26-16/h2-7H,8-14H2,1H3/p+1