[(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: [(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 2-methyl-5-methylsulfonyl-benzoate Openeye Name: [(1S)-1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic 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] 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid [(1S)-1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl] ester Formula: C17H16N2O5S2 MolecularWeight: 392.44934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OC(C)C2=NN=C(O2)C3=CC=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)O[C@@H](C)C2=NN=C(O2)C3=CC=CS3

InChI

InChI=1S/C17H16N2O5S2/c1-10-6-7-12(26(3,21)22)9-13(10)17(20)23-11(2)15-18-19-16(24-15)14-5-4-8-25-14/h4-9,11H,1-3H3/t11-/m0/s1