4-(2-methylsulfonylpyrimidin-4-yl)-3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 4-(2-methylsulfonylpyrimidin-4-yl)-3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 4-(2-methylsulfonylpyrimidin-4-yl)-3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 4-(2-methylsulfonyl-4-pyrimidinyl)-3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 4-(2-methylsulfonylpyrimidin-4-yl)-3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 4-(2-mesylpyrimidin-4-yl)-3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C16H13F3N4O3S MolecularWeight: 398.35963

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=CC(=N1)C2CC(=O)NN=C2C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=NC=CC(=N1)C2CC(=O)NN=C2C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C16H13F3N4O3S/c1-27(25,26)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/h2-7,11H,8H2,1H3,(H,22,24)