N-(2-chloranyl-4-fluoranyl-phenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-2-[4-(2-thienylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-chloro-4-fluorophenyl)-2-[4-(thiophen-2-ylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-2-[4-(2-thenyl)piperazin-1-ium-1-yl]acetamide Formula: C17H20ClFN3OS+ MolecularWeight: 368.876603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=C(C=C(C=C2)F)Cl)CC3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=C(C=C(C=C2)F)Cl)CC3=CC=CS3

InChI

InChI=1S/C17H19ClFN3OS/c18-15-10-13(19)3-4-16(15)20-17(23)12-22-7-5-21(6-8-22)11-14-2-1-9-24-14/h1-4,9-10H,5-8,11-12H2,(H,20,23)/p+1