(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C21H22N2O5S2 MolecularWeight: 446.53978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OCC3=COC(=N3)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OCC3=COC(=N3)C4=CC=CS4

InChI

InChI=1S/C21H22N2O5S2/c24-20(27-14-17-15-28-21(22-17)19-5-4-12-29-19)13-16-6-8-18(9-7-16)30(25,26)23-10-2-1-3-11-23/h4-9,12,15H,1-3,10-11,13-14H2