N1,N1-diethyl-N4-[(2-fluorophenyl)methyl]-N4-phenethyl-benzene-1,4-disulfonamide

Systemtic Name: N1,N1-diethyl-N4-[(2-fluorophenyl)methyl]-N4-phenethyl-benzene-1,4-disulfonamide Openeye Name: N1,N1-diethyl-N4-[(2-fluorophenyl)methyl]-N4-phenethyl-benzene-1,4-disulfonamide CAS Name: N1,N1-diethyl-N4-[(2-fluorophenyl)methyl]-N4-phenethylbenzene-1,4-disulfonamide IUPAC Name: 1-N,1-N-diethyl-4-N-[(2-fluorophenyl)methyl]-4-N-phenethylbenzene-1,4-disulfonamide Traditional Name: N,N-diethyl-N'-(2-fluorobenzyl)-N'-phenethyl-benzene-1,4-disulfonamide Formula: C25H29FN2O4S2 MolecularWeight: 504.637163

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3F

InChI

InChI=1S/C25H29FN2O4S2/c1-3-27(4-2)33(29,30)23-14-16-24(17-15-23)34(31,32)28(19-18-21-10-6-5-7-11-21)20-22-12-8-9-13-25(22)26/h5-17H,3-4,18-20H2,1-2H3