ethyl 1-[2-[[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[[2-(4-ethoxyphenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[2-(4-ethoxyphenyl)-5-methyl-4-oxazolyl]methylthio]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(5-methyl-2-p-phenetyl-oxazol-4-yl)methylthio]acetyl]isonipecotic acid ethyl ester Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(O2)C)CSCC(=O)N3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(O2)C)CSCC(=O)N3CCC(CC3)C(=O)OCC

InChI

InChI=1S/C23H30N2O5S/c1-4-28-19-8-6-17(7-9-19)22-24-20(16(3)30-22)14-31-15-21(26)25-12-10-18(11-13-25)23(27)29-5-2/h6-9,18H,4-5,10-15H2,1-3H3