[(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: [(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: [(1S)-1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl] 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid [(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] ester IUPAC Name: [(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-acetylpiperazino)sulfonylbenzoic acid [(1S)-1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl] ester Formula: C21H22N4O6S2 MolecularWeight: 490.55258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=CS2)OC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

C[C@@H](C1=NN=C(O1)C2=CC=CS2)OC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C21H22N4O6S2/c1-14(19-22-23-20(31-19)18-7-4-12-32-18)30-21(27)16-5-3-6-17(13-16)33(28,29)25-10-8-24(9-11-25)15(2)26/h3-7,12-14H,8-11H2,1-2H3/t14-/m0/s1