N-(2-fluorophenyl)-3-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: N-(2-fluorophenyl)-3-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]propanamide Openeye Name: N-(2-fluorophenyl)-3-[4-(2-thienylmethyl)piperazin-1-ium-1-yl]propanamide CAS Name: N-(2-fluorophenyl)-3-[4-(thiophen-2-ylmethyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: N-(2-fluorophenyl)-3-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]propanamide Traditional Name: N-(2-fluorophenyl)-3-[4-(2-thenyl)piperazin-1-ium-1-yl]propionamide Formula: C18H23FN3OS+ MolecularWeight: 348.458123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=CC=CC=C2F)CC3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=CC=CC=C2F)CC3=CC=CS3

InChI

InChI=1S/C18H22FN3OS/c19-16-5-1-2-6-17(16)20-18(23)7-8-21-9-11-22(12-10-21)14-15-4-3-13-24-15/h1-6,13H,7-12,14H2,(H,20,23)/p+1