1-[4-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[[2-(4-fluorophenyl)thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[[2-(4-fluorophenyl)-4-thiazolyl]methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[[2-(4-fluorophenyl)thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Formula: C16H19FN3OS+ MolecularWeight: 320.404963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC2=CSC(=N2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC2=CSC(=N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H18FN3OS/c1-12(21)20-8-6-19(7-9-20)10-15-11-22-16(18-15)13-2-4-14(17)5-3-13/h2-5,11H,6-10H2,1H3/p+1