N-(1-methylpyrazol-3-yl)-3-(3-methylsulfonylphenoxy)-5-(1-oxidanylpropan-2-yloxy)benzamide

Systemtic Name: N-(1-methylpyrazol-3-yl)-3-(3-methylsulfonylphenoxy)-5-(1-oxidanylpropan-2-yloxy)benzamide Openeye Name: 3-(2-hydroxy-1-methyl-ethoxy)-N-(1-methylpyrazol-3-yl)-5-(3-methylsulfonylphenoxy)benzamide CAS Name: 3-(1-hydroxypropan-2-yloxy)-N-(1-methyl-3-pyrazolyl)-5-(3-methylsulfonylphenoxy)benzamide IUPAC Name: 3-(1-hydroxypropan-2-yloxy)-N-(1-methylpyrazol-3-yl)-5-(3-methylsulfonylphenoxy)benzamide Traditional Name: 3-(2-hydroxy-1-methyl-ethoxy)-5-(3-mesylphenoxy)-N-(1-methylpyrazol-3-yl)benzamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)OC1=CC(=CC(=C1)OC2=CC(=CC=C2)S(=O)(=O)C)C(=O)NC3=NN(C=C3)C

Isomeric SMILES

CC(CO)OC1=CC(=CC(=C1)OC2=CC(=CC=C2)S(=O)(=O)C)C(=O)NC3=NN(C=C3)C

InChI

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