ethyl 1-[2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]propyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]thio]propanoyl]isonipecotic acid ethyl ester Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(C)SC2=NN=C(O2)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(C)SC2=NN=C(O2)C3=CN=CC=C3

InChI

InChI=1S/C18H22N4O4S/c1-3-25-17(24)13-6-9-22(10-7-13)16(23)12(2)27-18-21-20-15(26-18)14-5-4-8-19-11-14/h4-5,8,11-13H,3,6-7,9-10H2,1-2H3