N-(4-bromophenyl)-2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(4-bromophenyl)-2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: N-(4-bromophenyl)-2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonylanilino)acetamide IUPAC Name: N-(4-bromophenyl)-2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide Traditional Name: N-(4-bromophenyl)-2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetamide Formula: C21H18BrFN2O3S2 MolecularWeight: 509.411623

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)Br)C3=CC(=CC=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)Br)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H18BrFN2O3S2/c1-29-19-9-11-20(12-10-19)30(27,28)25(18-4-2-3-16(23)13-18)14-21(26)24-17-7-5-15(22)6-8-17/h2-13H,14H2,1H3,(H,24,26)