4-chloranyl-N-[1-(3,5-dimethylpyrazol-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-(3,5-dimethylpyrazol-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]benzenesulfonamide Openeye Name: N-[1-benzyl-2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]-4-chloro-benzenesulfonamide CAS Name: 4-chloro-N-[1-(3,5-dimethyl-1-pyrazolyl)-1-oxo-3-phenylpropan-2-yl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-(3,5-dimethylpyrazol-1-yl)-1-oxo-3-phenylpropan-2-yl]benzenesulfonamide Traditional Name: N-[1-benzyl-2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]-4-chloro-benzenesulfonamide Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=NN1C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C20H20ClN3O3S/c1-14-12-15(2)24(22-14)20(25)19(13-16-6-4-3-5-7-16)23-28(26,27)18-10-8-17(21)9-11-18/h3-12,19,23H,13H2,1-2H3