[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(4-fluorophenyl)thiazol-4-yl]methyl 1-(3-pyridylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(3-pyridinylsulfonyl)-4-piperidinecarboxylic acid [2-(4-fluorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-pyridylsulfonyl)isonipecotic acid [2-(4-fluorophenyl)thiazol-4-yl]methyl ester Formula: C21H20FN3O4S2 MolecularWeight: 461.529603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H20FN3O4S2/c22-17-5-3-15(4-6-17)20-24-18(14-30-20)13-29-21(26)16-7-10-25(11-8-16)31(27,28)19-2-1-9-23-12-19/h1-6,9,12,14,16H,7-8,10-11,13H2