N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-5-fluoranyl-2-(methylsulfonylamino)benzamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-5-fluoranyl-2-(methylsulfonylamino)benzamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-5-fluoro-2-(methanesulfonamido)benzamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-5-fluoro-2-(methanesulfonamido)benzamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-5-fluoro-2-(methanesulfonamido)benzamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-5-fluoro-2-(methanesulfonamido)benzamide Formula: C18H20BrFN2O5S MolecularWeight: 475.329203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=C(C=CC(=C2)F)NS(=O)(=O)C)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=C(C=CC(=C2)F)NS(=O)(=O)C)Br)OC

InChI

InChI=1S/C18H20BrFN2O5S/c1-26-16-8-11(14(19)10-17(16)27-2)6-7-21-18(23)13-9-12(20)4-5-15(13)22-28(3,24)25/h4-5,8-10,22H,6-7H2,1-3H3,(H,21,23)