1-[(2S)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: 1-[(2S)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-[(2S)-2-(2-fluorophenyl)thiazolidin-3-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-[(2S)-2-(2-fluorophenyl)-3-thiazolidinyl]-2-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-[(2S)-2-(2-fluorophenyl)-1,3-thiazolidin-3-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-[(2S)-2-(2-fluorophenyl)thiazolidin-3-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanone Formula: C20H25FN4OS+2 MolecularWeight: 388.502103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCSC2C3=CC=CC=C3F)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCS[C@H]2C3=CC=CC=C3F)C4=CC=CC=[NH+]4

InChI

InChI=1S/C20H23FN4OS/c21-17-6-2-1-5-16(17)20-25(13-14-27-20)19(26)15-23-9-11-24(12-10-23)18-7-3-4-8-22-18/h1-8,20H,9-15H2/p+2/t20-/m0/s1