(2-ethyl-1,3-thiazol-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate

Systemtic Name: (2-ethyl-1,3-thiazol-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate Openeye Name: (2-ethylthiazol-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate CAS Name: 1-methylsulfonyl-4-piperidinecarboxylic acid (2-ethyl-4-thiazolyl)methyl ester IUPAC Name: (2-ethyl-1,3-thiazol-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate Traditional Name: 1-mesylisonipecotic acid (2-ethylthiazol-4-yl)methyl ester Formula: C13H20N2O4S2 MolecularWeight: 332.4389

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)COC(=O)C2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CCC1=NC(=CS1)COC(=O)C2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C13H20N2O4S2/c1-3-12-14-11(9-20-12)8-19-13(16)10-4-6-15(7-5-10)21(2,17)18/h9-10H,3-8H2,1-2H3