5-ethanoyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-ethanoyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-3-yl]thiophene-2-carboxamide Openeye Name: 5-acetyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]-3-piperidyl]thiophene-2-carboxamide CAS Name: 5-acetyl-N-[(3S)-1-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-3-piperidinyl]-2-thiophenecarboxamide IUPAC Name: 5-acetyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-3-yl]thiophene-2-carboxamide Traditional Name: 5-acetyl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]-3-piperidyl]thiophene-2-carboxamide Formula: C18H19F3N3O2S+ MolecularWeight: 398.42257

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)NC2CCCN(C2)C3=[NH+]C=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)N[C@H]2CCCN(C2)C3=[NH+]C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O2S/c1-11(25)14-5-6-15(27-14)17(26)23-13-3-2-8-24(10-13)16-7-4-12(9-22-16)18(19,20)21/h4-7,9,13H,2-3,8,10H2,1H3,(H,23,26)/p+1/t13-/m0/s1