ethyl 1-[2-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]phenyl]carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]phenyl]carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[2-[(2-methylthiazol-4-yl)methylsulfanyl]benzoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[2-[(2-methyl-4-thiazolyl)methylthio]phenyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[2-[(2-methylthiazol-4-yl)methylthio]benzoyl]oxyacetyl]isonipecotic acid ethyl ester Formula: C22H26N2O5S2 MolecularWeight: 462.58224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CC=CC=C2SCC3=CSC(=N3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CC=CC=C2SCC3=CSC(=N3)C

InChI

InChI=1S/C22H26N2O5S2/c1-3-28-21(26)16-8-10-24(11-9-16)20(25)12-29-22(27)18-6-4-5-7-19(18)31-14-17-13-30-15(2)23-17/h4-7,13,16H,3,8-12,14H2,1-2H3