3-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-1,3-thiazol-2-one

Systemtic Name: 3-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-1,3-thiazol-2-one Openeye Name: 3-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-thiazol-2-one CAS Name: 3-[2-[4-(4-acetyl-2-fluorophenyl)-1-piperazin-1-iumyl]ethyl]-4-methyl-2-thiazolone IUPAC Name: 3-[2-[4-(4-acetyl-2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-1,3-thiazol-2-one Traditional Name: 3-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-4-thiazolin-2-one Formula: C18H23FN3O2S+ MolecularWeight: 364.457523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CC[NH+]2CCN(CC2)C3=C(C=C(C=C3)C(=O)C)F

Isomeric SMILES

CC1=CSC(=O)N1CC[NH+]2CCN(CC2)C3=C(C=C(C=C3)C(=O)C)F

InChI

InChI=1S/C18H22FN3O2S/c1-13-12-25-18(24)22(13)10-7-20-5-8-21(9-6-20)17-4-3-15(14(2)23)11-16(17)19/h3-4,11-12H,5-10H2,1-2H3/p+1