[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid [2-(4-ethoxy-3-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid [2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl ester Formula: C23H26N2O6S3 MolecularWeight: 522.65734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)OC

InChI

InChI=1S/C23H26N2O6S3/c1-3-30-19-7-6-17(13-20(19)29-2)22-24-18(15-33-22)14-31-23(26)16-8-10-25(11-9-16)34(27,28)21-5-4-12-32-21/h4-7,12-13,15-16H,3,8-11,14H2,1-2H3