[(1R)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: [(1R)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: [(1R)-1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [(1R)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] ester IUPAC Name: [(1R)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid [(1R)-1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl] ester Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OC(C)C3=NN=C(O3)C4=CC=CS4

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)O[C@H](C)C3=NN=C(O3)C4=CC=CS4

InChI

InChI=1S/C21H19N3O3S/c1-4-15-12(2)18(14-8-5-6-9-16(14)22-15)21(25)26-13(3)19-23-24-20(27-19)17-10-7-11-28-17/h5-11,13H,4H2,1-3H3/t13-/m1/s1