(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [2-(2-thienyl)thiazol-4-yl]methyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxylic acid (2-thiophen-2-yl-4-thiazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-mesitylsulfonylisonipecotic acid [2-(2-thienyl)thiazol-4-yl]methyl ester Formula: C23H26N2O4S3 MolecularWeight: 490.65854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CSC(=N3)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CSC(=N3)C4=CC=CS4)C

InChI

InChI=1S/C23H26N2O4S3/c1-15-11-16(2)21(17(3)12-15)32(27,28)25-8-6-18(7-9-25)23(26)29-13-19-14-31-22(24-19)20-5-4-10-30-20/h4-5,10-12,14,18H,6-9,13H2,1-3H3