ethyl 1-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanoyl]-4-phenethyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanoyl]-4-phenethyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-methylthiazol-2-yl)sulfanylacetyl]-4-phenethyl-piperidine-4-carboxylate CAS Name: 1-[2-[(4-methyl-2-thiazolyl)thio]-1-oxoethyl]-4-phenethyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetyl]-4-phenethylpiperidine-4-carboxylate Traditional Name: 1-[2-[(4-methylthiazol-2-yl)thio]acetyl]-4-phenethyl-isonipecotic acid ethyl ester Formula: C22H28N2O3S2 MolecularWeight: 432.59932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)CSC2=NC(=CS2)C)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)CSC2=NC(=CS2)C)CCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3S2/c1-3-27-20(26)22(10-9-18-7-5-4-6-8-18)11-13-24(14-12-22)19(25)16-29-21-23-17(2)15-28-21/h4-8,15H,3,9-14,16H2,1-2H3