3-[1-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanoyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[1-oxo-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-[[5-(trifluoromethyl)-2-pyridyl]thio]acetyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C20H19F3N4O2S MolecularWeight: 436.45067

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)CSC4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)CSC4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H19F3N4O2S/c21-20(22,23)13-5-6-17(24-11-13)30-12-18(28)26-9-7-14(8-10-26)27-16-4-2-1-3-15(16)25-19(27)29/h1-6,11,14H,7-10,12H2,(H,25,29)