2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(2-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(2-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonyl-anilino)-N-(2-methyl-3-nitro-phenyl)acetamide CAS Name: 2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonylanilino)-N-(2-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-(2-methyl-3-nitrophenyl)acetamide Traditional Name: 2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonyl-anilino)-N-(2-methyl-3-nitro-phenyl)acetamide Formula: C22H20FN3O5S2 MolecularWeight: 489.539703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN(C2=CC(=CC=C2)F)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN(C2=CC(=CC=C2)F)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C22H20FN3O5S2/c1-15-20(7-4-8-21(15)26(28)29)24-22(27)14-25(17-6-3-5-16(23)13-17)33(30,31)19-11-9-18(32-2)10-12-19/h3-13H,14H2,1-2H3,(H,24,27)