N-(4-fluorophenyl)-5-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-fluorophenyl)-5-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-fluorophenyl)-5-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-fluorophenyl)-5-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-fluorophenyl)-5-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-fluorophenyl)-5-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-carboxamide Formula: C16H20FN4OS+ MolecularWeight: 335.419603

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=NN=C(S2)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=NN=C(S2)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C16H19FN4OS/c1-11-3-2-8-21(9-11)10-14-19-20-16(23-14)15(22)18-13-6-4-12(17)5-7-13/h4-7,11H,2-3,8-10H2,1H3,(H,18,22)/p+1/t11-/m0/s1