N-(2,5-dimethylphenyl)-2-[(4-fluoranyl-3-nitro-phenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[(4-fluoranyl-3-nitro-phenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[(4-fluoro-3-nitro-phenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[(4-fluoro-3-nitrophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[(4-fluoro-3-nitrophenyl)sulfonyl-methylamino]acetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[(4-fluoro-3-nitro-phenyl)sulfonyl-methyl-amino]acetamide Formula: C17H18FN3O5S MolecularWeight: 395.405323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18FN3O5S/c1-11-4-5-12(2)15(8-11)19-17(22)10-20(3)27(25,26)13-6-7-14(18)16(9-13)21(23)24/h4-9H,10H2,1-3H3,(H,19,22)