3-[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-2-phenyl-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-2-phenyl-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]-2-phenyl-thiazolidine-4-carboxylic acid CAS Name: 3-[3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]-2-phenyl-4-thiazolidinecarboxylic acid IUPAC Name: 3-[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-2-phenyl-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]-2-phenyl-thiazolidine-4-carboxylic acid Formula: C20H28N2O5S MolecularWeight: 408.51172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1C(CSC1C2=CC=CC=C2)C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(C(=O)N1C(CSC1C2=CC=CC=C2)C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H28N2O5S/c1-12(2)15(21-19(26)27-20(3,4)5)16(23)22-14(18(24)25)11-28-17(22)13-9-7-6-8-10-13/h6-10,12,14-15,17H,11H2,1-5H3,(H,21,26)(H,24,25)