4-[[2-[1-(3-bromophenyl)-2,2-dicyano-ethyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[2-[1-(3-bromophenyl)-2,2-dicyano-ethyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl]amino]benzenesulfonamide Openeye Name: 4-[[2-[1-(3-bromophenyl)-2,2-dicyano-ethyl]-5,5-dimethyl-3-oxo-cyclohexen-1-yl]amino]benzenesulfonamide CAS Name: 4-[[2-[1-(3-bromophenyl)-2,2-dicyanoethyl]-5,5-dimethyl-3-oxo-1-cyclohexenyl]amino]benzenesulfonamide IUPAC Name: 4-[[2-[1-(3-bromophenyl)-2,2-dicyanoethyl]-5,5-dimethyl-3-oxocyclohexen-1-yl]amino]benzenesulfonamide Traditional Name: 4-[[2-[1-(3-bromophenyl)-2,2-dicyano-ethyl]-3-keto-5,5-dimethyl-cyclohexen-1-yl]amino]benzenesulfonamide Formula: C24H23BrN4O3S MolecularWeight: 527.43342

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(C2=CC(=CC=C2)Br)C(C#N)C#N)NC3=CC=C(C=C3)S(=O)(=O)N)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(C2=CC(=CC=C2)Br)C(C#N)C#N)NC3=CC=C(C=C3)S(=O)(=O)N)C

InChI

InChI=1S/C24H23BrN4O3S/c1-24(2)11-20(29-18-6-8-19(9-7-18)33(28,31)32)23(21(30)12-24)22(16(13-26)14-27)15-4-3-5-17(25)10-15/h3-10,16,22,29H,11-12H2,1-2H3,(H2,28,31,32)