N-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[4-bromo-1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[4-bromo-1-(2-fluorobenzyl)pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide Formula: C18H17BrFN3O4S MolecularWeight: 470.312683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3F

InChI

InChI=1S/C18H17BrFN3O4S/c1-26-13-7-8-16(27-2)17(9-13)28(24,25)22-18-14(19)11-23(21-18)10-12-5-3-4-6-15(12)20/h3-9,11H,10H2,1-2H3,(H,21,22)