2-[[5-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-[[5-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-[[5-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]thiazolidine-4-carboxylic acid CAS Name: 2-[[5-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-4-thiazolidinecarboxylic acid IUPAC Name: 2-[[5-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-[[5-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]thiazolidine-4-carboxylic acid Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(S1)CC2=C(N(N=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

C1C(NC(S1)CC2=C(N(N=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C20H18ClN3O2S/c21-15-8-6-13(7-9-15)19-14(10-18-23-17(12-27-18)20(25)26)11-22-24(19)16-4-2-1-3-5-16/h1-9,11,17-18,23H,10,12H2,(H,25,26)