4-methyl-3-[[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-one

Systemtic Name: 4-methyl-3-[[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-one Openeye Name: 4-methyl-3-[[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium-1-yl]methyl]thiazol-2-one CAS Name: 4-methyl-3-[[4-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazin-1-iumyl]methyl]-2-thiazolone IUPAC Name: 4-methyl-3-[[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-one Traditional Name: 4-methyl-3-[[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium-1-yl]methyl]-4-thiazolin-2-one Formula: C15H19F3N4OS+2 MolecularWeight: 360.39777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1C[NH+]2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CSC(=O)N1C[NH+]2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C15H17F3N4OS/c1-11-9-24-14(23)22(11)10-20-4-6-21(7-5-20)13-3-2-12(8-19-13)15(16,17)18/h2-3,8-9H,4-7,10H2,1H3/p+2