N-(2-chloranyl-5-nitro-phenyl)-2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonylanilino)acetamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetamide Formula: C21H17ClFN3O5S2 MolecularWeight: 509.958183

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C3=CC(=CC=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H17ClFN3O5S2/c1-32-17-6-8-18(9-7-17)33(30,31)25(15-4-2-3-14(23)11-15)13-21(27)24-20-12-16(26(28)29)5-10-19(20)22/h2-12H,13H2,1H3,(H,24,27)