[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 1-ethylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 1-ethylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(3-methoxyphenyl)thiazol-4-yl]methyl 1-ethylsulfonylpiperidine-4-carboxylate CAS Name: 1-ethylsulfonyl-4-piperidinecarboxylic acid [2-(3-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 1-ethylsulfonylpiperidine-4-carboxylate Traditional Name: 1-esylisonipecotic acid [2-(3-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C19H24N2O5S2 MolecularWeight: 424.53426

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)OCC2=CSC(=N2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)OCC2=CSC(=N2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H24N2O5S2/c1-3-28(23,24)21-9-7-14(8-10-21)19(22)26-12-16-13-27-18(20-16)15-5-4-6-17(11-15)25-2/h4-6,11,13-14H,3,7-10,12H2,1-2H3