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

Systemtic Name: 2-[(4-fluoranyl-3-nitro-phenyl)sulfonyl-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[(4-fluoro-3-nitro-phenyl)sulfonyl-methyl-amino]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[(4-fluoro-3-nitrophenyl)sulfonyl-methylamino]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[(4-fluoro-3-nitrophenyl)sulfonyl-methylamino]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[(4-fluoro-3-nitro-phenyl)sulfonyl-methyl-amino]-N-[2-(methylthio)phenyl]acetamide Formula: C16H16FN3O5S2 MolecularWeight: 413.443743

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)S(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)S(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H16FN3O5S2/c1-19(10-16(21)18-13-5-3-4-6-15(13)26-2)27(24,25)11-7-8-12(17)14(9-11)20(22)23/h3-9H,10H2,1-2H3,(H,18,21)