N-[1-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]pyrazol-4-yl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]pyrazol-4-yl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenoxy)methyl]pyrazol-4-yl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[1-[(2-chloro-4-fluorophenoxy)methyl]-4-pyrazolyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenoxy)methyl]pyrazol-4-yl]-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[1-[(2-chloro-4-fluoro-phenoxy)methyl]pyrazol-4-yl]-2,5-dimethoxy-benzenesulfonamide Formula: C18H17ClFN3O5S MolecularWeight: 441.861083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=CN(N=C2)COC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=CN(N=C2)COC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C18H17ClFN3O5S/c1-26-14-4-6-17(27-2)18(8-14)29(24,25)22-13-9-21-23(10-13)11-28-16-5-3-12(20)7-15(16)19/h3-10,22H,11H2,1-2H3