O1-tert-butyl O3-[2-oxidanylidene-2-(thiophen-2-ylmethylcarbamoylamino)ethyl] (3R)-piperidine-1,3-dicarboxylate

Systemtic Name: O1-tert-butyl O3-[2-oxidanylidene-2-(thiophen-2-ylmethylcarbamoylamino)ethyl] (3R)-piperidine-1,3-dicarboxylate Openeye Name: O1-tert-butyl O3-[2-oxo-2-(2-thienylmethylcarbamoylamino)ethyl] (3R)-piperidine-1,3-dicarboxylate CAS Name: (3R)-piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-[2-oxo-2-[[oxo-(thiophen-2-ylmethylamino)methyl]amino]ethyl] ester IUPAC Name: 1-O-tert-butyl 3-O-[2-oxo-2-(thiophen-2-ylmethylcarbamoylamino)ethyl] (3R)-piperidine-1,3-dicarboxylate Traditional Name: (3R)-piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-[2-keto-2-(2-thenylcarbamoylamino)ethyl] ester Formula: C19H27N3O6S MolecularWeight: 425.49918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)OCC(=O)NC(=O)NCC2=CC=CS2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H](C1)C(=O)OCC(=O)NC(=O)NCC2=CC=CS2

InChI

InChI=1S/C19H27N3O6S/c1-19(2,3)28-18(26)22-8-4-6-13(11-22)16(24)27-12-15(23)21-17(25)20-10-14-7-5-9-29-14/h5,7,9,13H,4,6,8,10-12H2,1-3H3,(H2,20,21,23,25)/t13-/m1/s1