N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-fluoranyl-3-sulfamoyl-benzamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-fluoranyl-3-sulfamoyl-benzamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-4-fluoro-3-sulfamoyl-benzamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-fluoro-3-sulfamoylbenzamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-fluoro-3-sulfamoylbenzamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-4-fluoro-3-sulfamoyl-benzamide Formula: C16H15BrFN3O4S MolecularWeight: 444.275403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N

InChI

InChI=1S/C16H15BrFN3O4S/c1-9-6-11(17)3-5-13(9)21-15(22)8-20-16(23)10-2-4-12(18)14(7-10)26(19,24)25/h2-7H,8H2,1H3,(H,20,23)(H,21,22)(H2,19,24,25)