N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-propan-2-yl-benzenesulfonamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-propan-2-yl-benzenesulfonamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-isopropyl-benzenesulfonamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-4-propan-2-ylbenzenesulfonamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-4-propan-2-ylbenzenesulfonamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)-3,5-dimethyl-pyrazol-4-yl]-4-isopropyl-benzenesulfonamide Formula: C21H23ClFN3O2S MolecularWeight: 435.942623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=C(C=C2)F)Cl)C)NS(=O)(=O)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=C(C=C2)F)Cl)C)NS(=O)(=O)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H23ClFN3O2S/c1-13(2)16-6-9-19(10-7-16)29(27,28)25-21-14(3)24-26(15(21)4)12-17-5-8-18(23)11-20(17)22/h5-11,13,25H,12H2,1-4H3