5-[5-(4-ethynyl-3-fluoranyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonyl-pyridine

Systemtic Name: 5-[5-(4-ethynyl-3-fluoranyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonyl-pyridine Openeye Name: 5-[5-(4-ethynyl-3-fluoro-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonyl-pyridine CAS Name: 5-[5-(4-ethynyl-3-fluorophenyl)-3-(trifluoromethyl)-1-pyrazolyl]-2-methylsulfonylpyridine IUPAC Name: 5-[5-(4-ethynyl-3-fluorophenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonylpyridine Traditional Name: 5-[5-(4-ethynyl-3-fluoro-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-mesyl-pyridine Formula: C18H11F4N3O2S MolecularWeight: 409.357453

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC(=C(C=C3)C#C)F

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC(=C(C=C3)C#C)F

InChI

InChI=1S/C18H11F4N3O2S/c1-3-11-4-5-12(8-14(11)19)15-9-16(18(20,21)22)24-25(15)13-6-7-17(23-10-13)28(2,26)27/h1,4-10H,2H3