3-[3-methyl-2-(3-phenylpropanoylamino)butanoyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[3-methyl-2-(3-phenylpropanoylamino)butanoyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[3-methyl-2-(3-phenylpropanoylamino)butanoyl]thiazolidine-4-carboxylic acid CAS Name: 3-[3-methyl-1-oxo-2-[(1-oxo-3-phenylpropyl)amino]butyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-[3-methyl-2-(3-phenylpropanoylamino)butanoyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[2-(hydrocinnamoylamino)-3-methyl-butanoyl]thiazolidine-4-carboxylic acid Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CSCC1C(=O)O)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)N1CSCC1C(=O)O)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C18H24N2O4S/c1-12(2)16(17(22)20-11-25-10-14(20)18(23)24)19-15(21)9-8-13-6-4-3-5-7-13/h3-7,12,14,16H,8-11H2,1-2H3,(H,19,21)(H,23,24)