5-(1-acetamido-3-methyl-butyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(1,3-thiazol-2-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(1-acetamido-3-methyl-butyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(1,3-thiazol-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 5-(1-acetamido-3-methyl-butyl)-1-tert-butoxycarbonyl-4-thiazol-2-yl-pyrrolidine-2-carboxylic acid CAS Name: 5-(1-acetamido-3-methylbutyl)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-(2-thiazolyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(1-acetamido-3-methylbutyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(1,3-thiazol-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(1-acetamido-3-methyl-butyl)-1-tert-butoxycarbonyl-4-thiazol-2-yl-proline Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1C(CC(N1C(=O)OC(C)(C)C)C(=O)O)C2=NC=CS2)NC(=O)C

Isomeric SMILES

CC(C)CC(C1C(CC(N1C(=O)OC(C)(C)C)C(=O)O)C2=NC=CS2)NC(=O)C

InChI

InChI=1S/C20H31N3O5S/c1-11(2)9-14(22-12(3)24)16-13(17-21-7-8-29-17)10-15(18(25)26)23(16)19(27)28-20(4,5)6/h7-8,11,13-16H,9-10H2,1-6H3,(H,22,24)(H,25,26)