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

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-[(4-methylsulfonylphenyl)methyl]-1,3-thiazolidin-4-one Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-[(4-methylsulfonylphenyl)methyl]thiazolidin-4-one CAS Name: 2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-[(4-methylsulfonylphenyl)methyl]-4-thiazolidinone IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-[(4-methylsulfonylphenyl)methyl]-1,3-thiazolidin-4-one Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(4-mesylbenzyl)thiazolidin-4-one Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S2/c1-15-21(16(2)25(23-15)18-7-5-4-6-8-18)22-24(20(26)14-29-22)13-17-9-11-19(12-10-17)30(3,27)28/h4-12,22H,13-14H2,1-3H3