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

Systemtic Name: N-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-propan-2-yl-benzenesulfonamide Openeye Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-isopropyl-benzenesulfonamide CAS Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]-3-pyrazolyl]-4-propan-2-ylbenzenesulfonamide IUPAC Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-4-propan-2-ylbenzenesulfonamide Traditional Name: N-[4-bromo-1-(4-fluorobenzyl)pyrazol-3-yl]-4-isopropyl-benzenesulfonamide Formula: C19H19BrFN3O2S MolecularWeight: 452.340463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrFN3O2S/c1-13(2)15-5-9-17(10-6-15)27(25,26)23-19-18(20)12-24(22-19)11-14-3-7-16(21)8-4-14/h3-10,12-13H,11H2,1-2H3,(H,22,23)