2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Formula: C16H14ClFN2O3S2 MolecularWeight: 400.875363

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H14ClFN2O3S2/c1-20(2)25(21,22)10-6-7-15-14(8-10)19-16(23-15)24-9-11-12(17)4-3-5-13(11)18/h3-8H,9H2,1-2H3