4-[5-(4-ethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-(hydroxymethyl)benzenesulfonamide

Systemtic Name: 4-[5-(4-ethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-(hydroxymethyl)benzenesulfonamide Openeye Name: 4-[5-(4-ethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-(hydroxymethyl)benzenesulfonamide CAS Name: 4-[5-(4-ethylphenyl)-3-(trifluoromethyl)-1-pyrazolyl]-2-(hydroxymethyl)benzenesulfonamide IUPAC Name: 4-[5-(4-ethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-(hydroxymethyl)benzenesulfonamide Traditional Name: 4-[5-(4-ethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylol-benzenesulfonamide Formula: C19H18F3N3O3S MolecularWeight: 425.42473

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)S(=O)(=O)N)CO)C(F)(F)F

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)S(=O)(=O)N)CO)C(F)(F)F

InChI

InChI=1S/C19H18F3N3O3S/c1-2-12-3-5-13(6-4-12)16-10-18(19(20,21)22)24-25(16)15-7-8-17(29(23,27)28)14(9-15)11-26/h3-10,26H,2,11H2,1H3,(H2,23,27,28)