3-(5-chloranyl-2-fluoranyl-4-methylsulfonyl-phenoxy)-N-(1-methylpyrazol-3-yl)-5-[(2S)-1-oxidanylpropan-2-yl]oxy-benzamide

Systemtic Name: 3-(5-chloranyl-2-fluoranyl-4-methylsulfonyl-phenoxy)-N-(1-methylpyrazol-3-yl)-5-[(2S)-1-oxidanylpropan-2-yl]oxy-benzamide Openeye Name: 3-(5-chloro-2-fluoro-4-methylsulfonyl-phenoxy)-5-[(1S)-2-hydroxy-1-methyl-ethoxy]-N-(1-methylpyrazol-3-yl)benzamide CAS Name: 3-(5-chloro-2-fluoro-4-methylsulfonylphenoxy)-5-[(2S)-1-hydroxypropan-2-yl]oxy-N-(1-methyl-3-pyrazolyl)benzamide IUPAC Name: 3-(5-chloro-2-fluoro-4-methylsulfonylphenoxy)-5-[(2S)-1-hydroxypropan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide Traditional Name: 3-(5-chloro-2-fluoro-4-mesyl-phenoxy)-5-[(1S)-2-hydroxy-1-methyl-ethoxy]-N-(1-methylpyrazol-3-yl)benzamide Formula: C21H21ClFN3O6S MolecularWeight: 497.924343

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)OC1=CC(=CC(=C1)OC2=CC(=C(C=C2F)S(=O)(=O)C)Cl)C(=O)NC3=NN(C=C3)C

Isomeric SMILES

C[C@@H](CO)OC1=CC(=CC(=C1)OC2=CC(=C(C=C2F)S(=O)(=O)C)Cl)C(=O)NC3=NN(C=C3)C

InChI

InChI=1S/C21H21ClFN3O6S/c1-12(11-27)31-14-6-13(21(28)24-20-4-5-26(2)25-20)7-15(8-14)32-18-9-16(22)19(10-17(18)23)33(3,29)30/h4-10,12,27H,11H2,1-3H3,(H,24,25,28)/t12-/m0/s1