(2-phenyl-1,3-thiazol-4-yl)methyl 1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: (2-phenylthiazol-4-yl)methyl 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid (2-phenylthiazol-4-yl)methyl ester Formula: C22H22N2O4S2 MolecularWeight: 442.55108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O4S2/c25-22(28-15-18-16-29-21(23-18)17-9-3-1-4-10-17)20-13-7-8-14-24(20)30(26,27)19-11-5-2-6-12-19/h1-6,9-12,16,20H,7-8,13-15H2