O1-tert-butyl O4-[(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[(3R)-3-cyano-3-(4-methylthiazol-2-yl)-2-oxo-propyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[(3R)-3-cyano-3-(4-methyl-2-thiazolyl)-2-oxopropyl] ester IUPAC Name: 1-O-tert-butyl 4-O-[(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxopropyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[(3R)-3-cyano-2-keto-3-(4-methylthiazol-2-yl)propyl] ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CSC(=N1)[C@H](C#N)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H25N3O5S/c1-12-11-28-16(21-12)14(9-20)15(23)10-26-17(24)13-5-7-22(8-6-13)18(25)27-19(2,3)4/h11,13-14H,5-8,10H2,1-4H3/t14-/m1/s1