4-[4-(3-fluoranyl-4-methoxy-phenyl)-5-(hydroxymethyl)-1-phenethyl-pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-[4-(3-fluoranyl-4-methoxy-phenyl)-5-(hydroxymethyl)-1-phenethyl-pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-[4-(3-fluoro-4-methoxy-phenyl)-5-(hydroxymethyl)-1-phenethyl-pyrazol-3-yl]benzenesulfonamide CAS Name: 4-[4-(3-fluoro-4-methoxyphenyl)-5-(hydroxymethyl)-1-phenethyl-3-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[4-(3-fluoro-4-methoxyphenyl)-5-(hydroxymethyl)-1-phenethylpyrazol-3-yl]benzenesulfonamide Traditional Name: 4-[4-(3-fluoro-4-methoxy-phenyl)-5-methylol-1-phenethyl-pyrazol-3-yl]benzenesulfonamide Formula: C25H24FN3O4S MolecularWeight: 481.539163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CCC4=CC=CC=C4)CO)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CCC4=CC=CC=C4)CO)F

InChI

InChI=1S/C25H24FN3O4S/c1-33-23-12-9-19(15-21(23)26)24-22(16-30)29(14-13-17-5-3-2-4-6-17)28-25(24)18-7-10-20(11-8-18)34(27,31)32/h2-12,15,30H,13-14,16H2,1H3,(H2,27,31,32)