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

Systemtic Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(3-methoxyphenyl)thiazol-4-yl]methyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid [2-(3-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid [2-(3-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C21H22N2O5S3 MolecularWeight: 478.60478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC(=CS2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC(=CS2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H22N2O5S3/c1-27-18-5-2-4-16(12-18)20-22-17(14-30-20)13-28-21(24)15-7-9-23(10-8-15)31(25,26)19-6-3-11-29-19/h2-6,11-12,14-15H,7-10,13H2,1H3