6-[4-(trifluoromethyl)piperidin-1-yl]pyridin-1-ium-3-carbothioamide

Systemtic Name: 6-[4-(trifluoromethyl)piperidin-1-yl]pyridin-1-ium-3-carbothioamide Openeye Name: 6-[4-(trifluoromethyl)-1-piperidyl]pyridin-1-ium-3-carbothioamide CAS Name: 6-[4-(trifluoromethyl)-1-piperidinyl]-3-pyridin-1-iumcarbothioamide IUPAC Name: 6-[4-(trifluoromethyl)piperidin-1-yl]pyridin-1-ium-3-carbothioamide Traditional Name: 6-[4-(trifluoromethyl)piperidino]pyridin-1-ium-3-carbothioamide Formula: C12H15F3N3S+ MolecularWeight: 290.32781

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(F)(F)F)C2=[NH+]C=C(C=C2)C(=S)N

Isomeric SMILES

C1CN(CCC1C(F)(F)F)C2=[NH+]C=C(C=C2)C(=S)N

InChI

InChI=1S/C12H14F3N3S/c13-12(14,15)9-3-5-18(6-4-9)10-2-1-8(7-17-10)11(16)19/h1-2,7,9H,3-6H2,(H2,16,19)/p+1