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

Systemtic Name: (2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [2-(2-thienyl)thiazol-4-yl]methyl 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-cyanophenyl)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-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-cyanophenyl)sulfonylisonipecotic acid [2-(2-thienyl)thiazol-4-yl]methyl ester Formula: C21H19N3O4S3 MolecularWeight: 473.58826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CSC(=N2)C3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CSC(=N2)C3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H19N3O4S3/c22-12-15-3-5-18(6-4-15)31(26,27)24-9-7-16(8-10-24)21(25)28-13-17-14-30-20(23-17)19-2-1-11-29-19/h1-6,11,14,16H,7-10,13H2