2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-bromanyl-2-fluoranyl-phenyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-bromanyl-2-fluoranyl-phenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-bromo-2-fluoro-phenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-bromo-2-fluorophenyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-bromo-2-fluorophenyl)acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(mesyl)amino]-N-(4-bromo-2-fluoro-phenyl)acetamide Formula: C16H14BrFN2O5S MolecularWeight: 445.260163

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=C(C=C(C=C1)Br)F)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=C(C=C(C=C1)Br)F)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H14BrFN2O5S/c1-26(22,23)20(11-3-5-14-15(7-11)25-9-24-14)8-16(21)19-13-4-2-10(17)6-12(13)18/h2-7H,8-9H2,1H3,(H,19,21)