N4,N4-diethyl-N1-(2-fluoranyl-5-methyl-phenyl)benzene-1,4-disulfonamide

Systemtic Name: N4,N4-diethyl-N1-(2-fluoranyl-5-methyl-phenyl)benzene-1,4-disulfonamide Openeye Name: N4,N4-diethyl-N1-(2-fluoro-5-methyl-phenyl)benzene-1,4-disulfonamide CAS Name: N4,N4-diethyl-N1-(2-fluoro-5-methylphenyl)benzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-diethyl-1-N-(2-fluoro-5-methylphenyl)benzene-1,4-disulfonamide Traditional Name: N',N'-diethyl-N-(2-fluoro-5-methyl-phenyl)benzene-1,4-disulfonamide Formula: C17H21FN2O4S2 MolecularWeight: 400.488043

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C)F

InChI

InChI=1S/C17H21FN2O4S2/c1-4-20(5-2)26(23,24)15-9-7-14(8-10-15)25(21,22)19-17-12-13(3)6-11-16(17)18/h6-12,19H,4-5H2,1-3H3