3-[3-[(1,5-dimethylpyrazol-4-yl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[3-[(1,5-dimethylpyrazol-4-yl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[3-[(1,5-dimethylpyrazole-4-carbonyl)amino]-2-hydroxy-4-phenyl-butanoyl]-5,5-dimethyl-thiazolidine-4-carboxylic acid CAS Name: 3-[3-[[(1,5-dimethyl-4-pyrazolyl)-oxomethyl]amino]-2-hydroxy-1-oxo-4-phenylbutyl]-5,5-dimethyl-4-thiazolidinecarboxylic acid IUPAC Name: 3-[3-[(1,5-dimethylpyrazole-4-carbonyl)amino]-2-hydroxy-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[3-[(1,5-dimethylpyrazole-4-carbonyl)amino]-2-hydroxy-4-phenyl-butanoyl]-5,5-dimethyl-thiazolidine-4-carboxylic acid Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CSC(C3C(=O)O)(C)C)O

Isomeric SMILES

CC1=C(C=NN1C)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CSC(C3C(=O)O)(C)C)O

InChI

InChI=1S/C22H28N4O5S/c1-13-15(11-23-25(13)4)19(28)24-16(10-14-8-6-5-7-9-14)17(27)20(29)26-12-32-22(2,3)18(26)21(30)31/h5-9,11,16-18,27H,10,12H2,1-4H3,(H,24,28)(H,30,31)