N-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-ethoxy-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-ethoxy-benzenesulfonamide Openeye Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-ethoxy-benzenesulfonamide CAS Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]-3-pyrazolyl]-4-ethoxybenzenesulfonamide IUPAC Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-ethoxybenzenesulfonamide Traditional Name: N-[4-bromo-1-(4-fluorobenzyl)pyrazol-3-yl]-4-ethoxy-benzenesulfonamide Formula: C18H17BrFN3O3S MolecularWeight: 454.313283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=C(C=C3)F

InChI

InChI=1S/C18H17BrFN3O3S/c1-2-26-15-7-9-16(10-8-15)27(24,25)22-18-17(19)12-23(21-18)11-13-3-5-14(20)6-4-13/h3-10,12H,2,11H2,1H3,(H,21,22)