(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-acetylpiperazino)sulfonylbenzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C22H22N4O6S MolecularWeight: 470.49828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=NN=C(O3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=NN=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O6S/c1-16(27)25-10-12-26(13-11-25)33(29,30)19-9-5-8-18(14-19)22(28)31-15-20-23-24-21(32-20)17-6-3-2-4-7-17/h2-9,14H,10-13,15H2,1H3