[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 1-methylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 1-methylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(4-ethylphenyl)thiazol-4-yl]methyl 1-methylsulfonylpiperidine-4-carboxylate CAS Name: 1-methylsulfonyl-4-piperidinecarboxylic acid [2-(4-ethylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 1-methylsulfonylpiperidine-4-carboxylate Traditional Name: 1-mesylisonipecotic acid [2-(4-ethylphenyl)thiazol-4-yl]methyl ester Formula: C19H24N2O4S2 MolecularWeight: 408.53486

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C19H24N2O4S2/c1-3-14-4-6-15(7-5-14)18-20-17(13-26-18)12-25-19(22)16-8-10-21(11-9-16)27(2,23)24/h4-7,13,16H,3,8-12H2,1-2H3