4-bromanyl-N-[4-[[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]carbamoyl]phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[4-[[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]carbamoyl]phenyl]benzenesulfonamide Openeye Name: 4-bromo-N-[4-[[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]carbamoyl]phenyl]benzenesulfonamide CAS Name: 4-bromo-N-[4-[[(5,5-dimethyl-3-oxo-1-cyclohexenyl)hydrazo]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[4-[[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]carbamoyl]phenyl]benzenesulfonamide Traditional Name: 4-bromo-N-[4-[[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]carbamoyl]phenyl]benzenesulfonamide Formula: C21H22BrN3O4S MolecularWeight: 492.38608

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C21H22BrN3O4S/c1-21(2)12-17(11-18(26)13-21)23-24-20(27)14-3-7-16(8-4-14)25-30(28,29)19-9-5-15(22)6-10-19/h3-11,23,25H,12-13H2,1-2H3,(H,24,27)