ethyl (3S)-1-[2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]thio]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]thio]acetyl]nipecotic acid ethyl ester Formula: C18H20FN3O4S MolecularWeight: 393.432503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3F

InChI

InChI=1S/C18H20FN3O4S/c1-2-25-17(24)12-6-5-9-22(10-12)15(23)11-27-18-21-20-16(26-18)13-7-3-4-8-14(13)19/h3-4,7-8,12H,2,5-6,9-11H2,1H3/t12-/m0/s1