4-[2-[[5-(4-dimethylaminophenyl)-3-oxidanylidene-cyclohexen-1-yl]amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[[5-(4-dimethylaminophenyl)-3-oxidanylidene-cyclohexen-1-yl]amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[[5-(4-dimethylaminophenyl)-3-oxo-cyclohexen-1-yl]amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[[5-(4-dimethylaminophenyl)-3-oxo-1-cyclohexenyl]amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[[5-(4-dimethylaminophenyl)-3-oxocyclohexen-1-yl]amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[[5-(4-dimethylaminophenyl)-3-keto-cyclohexen-1-yl]amino]ethyl]benzenesulfonamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2CC(=CC(=O)C2)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2CC(=CC(=O)C2)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H27N3O3S/c1-25(2)20-7-5-17(6-8-20)18-13-19(15-21(26)14-18)24-12-11-16-3-9-22(10-4-16)29(23,27)28/h3-10,15,18,24H,11-14H2,1-2H3,(H2,23,27,28)