2-[2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanoylamino]benzamide

Systemtic Name: 2-[2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanoylamino]benzamide Openeye Name: 2-[[2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetyl]amino]benzamide CAS Name: 2-[[2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonylanilino)-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)acetyl]amino]benzamide Traditional Name: 2-[[2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetyl]amino]benzamide Formula: C22H20FN3O4S2 MolecularWeight: 473.540303

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(=O)N)C3=CC(=CC=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(=O)N)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H20FN3O4S2/c1-31-17-9-11-18(12-10-17)32(29,30)26(16-6-4-5-15(23)13-16)14-21(27)25-20-8-3-2-7-19(20)22(24)28/h2-13H,14H2,1H3,(H2,24,28)(H,25,27)