[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4)OC

InChI

InChI=1S/C25H27N3O5S/c1-31-21-9-8-18(14-22(21)32-2)23-26-20(16-34-23)15-33-24(29)17-10-12-28(13-11-17)25(30)27-19-6-4-3-5-7-19/h3-9,14,16-17H,10-13,15H2,1-2H3,(H,27,30)