N4-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-N1-methyl-benzene-1,4-disulfonamide

Systemtic Name: N4-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-N1-methyl-benzene-1,4-disulfonamide Openeye Name: N4-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-N1-methyl-benzene-1,4-disulfonamide CAS Name: N4-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-N1-methylbenzene-1,4-disulfonamide IUPAC Name: 4-N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-1-N-methylbenzene-1,4-disulfonamide Traditional Name: N'-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-N-methyl-benzene-1,4-disulfonamide Formula: C17H22FN3O4S2 MolecularWeight: 415.502683

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC(=CC=C2)F)N(C)C

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC(=CC=C2)F)N(C)C

InChI

InChI=1S/C17H22FN3O4S2/c1-19-26(22,23)15-7-9-16(10-8-15)27(24,25)20-12-17(21(2)3)13-5-4-6-14(18)11-13/h4-11,17,19-20H,12H2,1-3H3