4-butyl-N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]benzenesulfonamide

Systemtic Name: 4-butyl-N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]benzenesulfonamide Openeye Name: 4-butyl-N-[1-[(2-chloro-6-fluoro-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]benzenesulfonamide CAS Name: 4-butyl-N-[1-[(2-chloro-6-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]benzenesulfonamide IUPAC Name: 4-butyl-N-[1-[(2-chloro-6-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]benzenesulfonamide Traditional Name: 4-butyl-N-[1-(2-chloro-6-fluoro-benzyl)-3,5-dimethyl-pyrazol-4-yl]benzenesulfonamide Formula: C22H25ClFN3O2S MolecularWeight: 449.969203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=C(C=CC=C3Cl)F)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=C(C=CC=C3Cl)F)C

InChI

InChI=1S/C22H25ClFN3O2S/c1-4-5-7-17-10-12-18(13-11-17)30(28,29)26-22-15(2)25-27(16(22)3)14-19-20(23)8-6-9-21(19)24/h6,8-13,26H,4-5,7,14H2,1-3H3