N-(5-methyl-1H-pyrazol-3-yl)-3-(4-methylsulfonylphenoxy)-5-[(2S)-1-oxidanylpropan-2-yl]oxy-benzamide

Systemtic Name: N-(5-methyl-1H-pyrazol-3-yl)-3-(4-methylsulfonylphenoxy)-5-[(2S)-1-oxidanylpropan-2-yl]oxy-benzamide Openeye Name: 3-[(1S)-2-hydroxy-1-methyl-ethoxy]-N-(5-methyl-1H-pyrazol-3-yl)-5-(4-methylsulfonylphenoxy)benzamide CAS Name: 3-[(2S)-1-hydroxypropan-2-yl]oxy-N-(5-methyl-1H-pyrazol-3-yl)-5-(4-methylsulfonylphenoxy)benzamide IUPAC Name: 3-[(2S)-1-hydroxypropan-2-yl]oxy-N-(5-methyl-1H-pyrazol-3-yl)-5-(4-methylsulfonylphenoxy)benzamide Traditional Name: 3-[(1S)-2-hydroxy-1-methyl-ethoxy]-5-(4-mesylphenoxy)-N-(5-methyl-1H-pyrazol-3-yl)benzamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC(=O)C2=CC(=CC(=C2)OC(C)CO)OC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=NN1)NC(=O)C2=CC(=CC(=C2)O[C@@H](C)CO)OC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H23N3O6S/c1-13-8-20(24-23-13)22-21(26)15-9-17(29-14(2)12-25)11-18(10-15)30-16-4-6-19(7-5-16)31(3,27)28/h4-11,14,25H,12H2,1-3H3,(H2,22,23,24,26)/t14-/m0/s1