5,5-dimethyl-3-[2-oxidanyl-3-(oxolan-2-ylcarbonylamino)-4-phenyl-butanoyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 5,5-dimethyl-3-[2-oxidanyl-3-(oxolan-2-ylcarbonylamino)-4-phenyl-butanoyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[2-hydroxy-4-phenyl-3-(tetrahydrofuran-2-carbonylamino)butanoyl]-5,5-dimethyl-thiazolidine-4-carboxylic acid CAS Name: 3-[2-hydroxy-1-oxo-3-[[oxo(2-oxolanyl)methyl]amino]-4-phenylbutyl]-5,5-dimethyl-4-thiazolidinecarboxylic acid IUPAC Name: 3-[2-hydroxy-3-(oxolane-2-carbonylamino)-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[2-hydroxy-4-phenyl-3-(tetrahydrofuran-2-carbonylamino)butanoyl]-5,5-dimethyl-thiazolidine-4-carboxylic acid Formula: C21H28N2O6S MolecularWeight: 436.52182

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CS1)C(=O)C(C(CC2=CC=CC=C2)NC(=O)C3CCCO3)O)C(=O)O)C

Isomeric SMILES

CC1(C(N(CS1)C(=O)C(C(CC2=CC=CC=C2)NC(=O)C3CCCO3)O)C(=O)O)C

InChI

InChI=1S/C21H28N2O6S/c1-21(2)17(20(27)28)23(12-30-21)19(26)16(24)14(11-13-7-4-3-5-8-13)22-18(25)15-9-6-10-29-15/h3-5,7-8,14-17,24H,6,9-12H2,1-2H3,(H,22,25)(H,27,28)