[2-(2-bromanyl-5-fluoranyl-phenyl)-1,3-benzoxazol-5-yl]-(3-ethanoylphenyl)sulfonyl-azanide

Systemtic Name: [2-(2-bromanyl-5-fluoranyl-phenyl)-1,3-benzoxazol-5-yl]-(3-ethanoylphenyl)sulfonyl-azanide Openeye Name: (3-acetylphenyl)sulfonyl-[2-(2-bromo-5-fluoro-phenyl)-1,3-benzoxazol-5-yl]azanide CAS Name: (3-acetylphenyl)sulfonyl-[2-(2-bromo-5-fluorophenyl)-1,3-benzoxazol-5-yl]azanide IUPAC Name: (3-acetylphenyl)sulfonyl-[2-(2-bromo-5-fluorophenyl)-1,3-benzoxazol-5-yl]azanide Traditional Name: (3-acetylphenyl)sulfonyl-[2-(2-bromo-5-fluoro-phenyl)-1,3-benzoxazol-5-yl]azanide Formula: C21H13BrFN2O4S- MolecularWeight: 488.306323

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)[N-]C2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)F)Br

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)[N-]C2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)F)Br

InChI

InChI=1S/C21H13BrFN2O4S/c1-12(26)13-3-2-4-16(9-13)30(27,28)25-15-6-8-20-19(11-15)24-21(29-20)17-10-14(23)5-7-18(17)22/h2-11H,1H3/q-1