[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl 3-piperidin-1-ylsulfonylthiophene-2-carboxylate

Systemtic Name: [2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl 3-piperidin-1-ylsulfonylthiophene-2-carboxylate Openeye Name: [2-(4-methoxyphenyl)oxazol-4-yl]methyl 3-(1-piperidylsulfonyl)thiophene-2-carboxylate CAS Name: 3-(1-piperidinylsulfonyl)-2-thiophenecarboxylic acid [2-(4-methoxyphenyl)-4-oxazolyl]methyl ester IUPAC Name: [2-(4-methoxyphenyl)-1,3-oxazol-4-yl]methyl 3-piperidin-1-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-piperidinosulfonylthiophene-2-carboxylic acid [2-(4-methoxyphenyl)oxazol-4-yl]methyl ester Formula: C21H22N2O6S2 MolecularWeight: 462.53918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CO2)COC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CO2)COC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H22N2O6S2/c1-27-17-7-5-15(6-8-17)20-22-16(13-28-20)14-29-21(24)19-18(9-12-30-19)31(25,26)23-10-3-2-4-11-23/h5-9,12-13H,2-4,10-11,14H2,1H3