N-[1-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]pyrazol-4-yl]-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]pyrazol-4-yl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenoxy)methyl]pyrazol-4-yl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[1-[(2-chloro-4-fluorophenoxy)methyl]-4-pyrazolyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenoxy)methyl]pyrazol-4-yl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[1-[(2-chloro-4-fluoro-phenoxy)methyl]pyrazol-4-yl]-3,4-dimethoxy-benzenesulfonamide Formula: C18H17ClFN3O5S MolecularWeight: 441.861083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClFN3O5S/c1-26-17-6-4-14(8-18(17)27-2)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