N,N-diethyl-3-[[[4-(4-fluorophenyl)-4-oxidanylidene-butanoyl]amino]carbamoyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[[[4-(4-fluorophenyl)-4-oxidanylidene-butanoyl]amino]carbamoyl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[[[4-(4-fluorophenyl)-4-oxo-butanoyl]amino]carbamoyl]benzenesulfonamide CAS Name: N,N-diethyl-3-[[[4-(4-fluorophenyl)-1,4-dioxobutyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[[[4-(4-fluorophenyl)-4-oxobutanoyl]amino]carbamoyl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[[[4-(4-fluorophenyl)-4-keto-butanoyl]amino]carbamoyl]benzenesulfonamide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H24FN3O5S/c1-3-25(4-2)31(29,30)18-7-5-6-16(14-18)21(28)24-23-20(27)13-12-19(26)15-8-10-17(22)11-9-15/h5-11,14H,3-4,12-13H2,1-2H3,(H,23,27)(H,24,28)