[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 3-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 3-piperidin-1-ylsulfonylbenzoate Openeye Name: [2-(4-fluorophenyl)thiazol-4-yl]methyl 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid [2-(4-fluorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid [2-(4-fluorophenyl)thiazol-4-yl]methyl ester Formula: C22H21FN2O4S2 MolecularWeight: 460.541543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN2O4S2/c23-18-9-7-16(8-10-18)21-24-19(15-30-21)14-29-22(26)17-5-4-6-20(13-17)31(27,28)25-11-2-1-3-12-25/h4-10,13,15H,1-3,11-12,14H2