3-chloranyl-N-[1-(2-cyanoethyl)-3-oxidanylidene-2H-indazol-5-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[1-(2-cyanoethyl)-3-oxidanylidene-2H-indazol-5-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: 3-chloro-N-[1-(2-cyanoethyl)-3-oxo-2H-indazol-5-yl]-4-fluoro-benzenesulfonamide CAS Name: 3-chloro-N-[1-(2-cyanoethyl)-3-oxo-2H-indazol-5-yl]-4-fluorobenzenesulfonamide IUPAC Name: 3-chloro-N-[1-(2-cyanoethyl)-3-oxo-2H-indazol-5-yl]-4-fluorobenzenesulfonamide Traditional Name: 3-chloro-N-[1-(2-cyanoethyl)-3-keto-indazolin-5-yl]-4-fluoro-benzenesulfonamide Formula: C16H12ClFN4O3S MolecularWeight: 394.807883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NS(=O)(=O)C3=CC(=C(C=C3)F)Cl)C(=O)NN2CCC#N

Isomeric SMILES

C1=CC2=C(C=C1NS(=O)(=O)C3=CC(=C(C=C3)F)Cl)C(=O)NN2CCC#N

InChI

InChI=1S/C16H12ClFN4O3S/c17-13-9-11(3-4-14(13)18)26(24,25)21-10-2-5-15-12(8-10)16(23)20-22(15)7-1-6-19/h2-5,8-9,21H,1,7H2,(H,20,23)