4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]methyl]benzenesulfonamide

Systemtic Name: 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]methyl]benzenesulfonamide Openeye Name: 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-oxo-thiazolidin-3-yl]methyl]benzenesulfonamide CAS Name: 4-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-4-oxo-3-thiazolidinyl]methyl]benzenesulfonamide IUPAC Name: 4-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-oxo-1,3-thiazolidin-3-yl]methyl]benzenesulfonamide Traditional Name: 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-keto-thiazolidin-3-yl]methyl]benzenesulfonamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3N(C(=O)CS3)CC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3N(C(=O)CS3)CC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C21H22N4O3S2/c1-14-20(15(2)25(23-14)17-6-4-3-5-7-17)21-24(19(26)13-29-21)12-16-8-10-18(11-9-16)30(22,27)28/h3-11,21H,12-13H2,1-2H3,(H2,22,27,28)