1-(1-methylpyrrol-2-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(1-methylpyrrol-2-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone Openeye Name: 1-(1-methylpyrrol-2-yl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-(1-methyl-2-pyrrolyl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-(1-methylpyrrol-2-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanone Traditional Name: 1-(1-methylpyrrol-2-yl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethanone Formula: C13H11F3N2OS MolecularWeight: 300.29945

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)CSC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CN1C=CC=C1C(=O)CSC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H11F3N2OS/c1-18-6-2-3-10(18)11(19)8-20-12-5-4-9(7-17-12)13(14,15)16/h2-7H,8H2,1H3