4-(2-methylsulfanylpyrimidin-4-yl)-3-[3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one

Systemtic Name: 4-(2-methylsulfanylpyrimidin-4-yl)-3-[3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 4-(2-methylsulfanylpyrimidin-4-yl)-3-[3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 4-[2-(methylthio)-4-pyrimidinyl]-3-[3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 4-(2-methylsulfanylpyrimidin-4-yl)-3-[3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 4-[2-(methylthio)pyrimidin-4-yl]-3-[3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C16H11F3N4OS MolecularWeight: 364.34495

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=CC(=O)NN=C2C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CSC1=NC=CC(=N1)C2=CC(=O)NN=C2C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C16H11F3N4OS/c1-25-15-20-6-5-12(21-15)11-8-13(24)22-23-14(11)9-3-2-4-10(7-9)16(17,18)19/h2-8H,1H3,(H,22,24)