4-[3-[bis(fluoranyl)methyl]-5-(3-bromanyl-4-methoxy-phenyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[3-[bis(fluoranyl)methyl]-5-(3-bromanyl-4-methoxy-phenyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-(3-bromo-4-methoxy-phenyl)-3-(difluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[5-(3-bromo-4-methoxyphenyl)-3-(difluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[5-(3-bromo-4-methoxyphenyl)-3-(difluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-(3-bromo-4-methoxy-phenyl)-3-(difluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C17H14BrF2N3O3S MolecularWeight: 458.277166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)F)Br

InChI

InChI=1S/C17H14BrF2N3O3S/c1-26-16-7-2-10(8-13(16)18)15-9-14(17(19)20)22-23(15)11-3-5-12(6-4-11)27(21,24)25/h2-9,17H,1H3,(H2,21,24,25)