methyl 1-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(5-phenyl-2-thioxo-1,3,4-oxadiazol-3-yl)methyl]piperidine-4-carboxylate CAS Name: 1-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]piperidine-4-carboxylate Traditional Name: 1-[(5-phenyl-2-thioxo-1,3,4-oxadiazol-3-yl)methyl]isonipecotic acid methyl ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)CN2C(=S)OC(=N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CCN(CC1)CN2C(=S)OC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3O3S/c1-21-15(20)13-7-9-18(10-8-13)11-19-16(23)22-14(17-19)12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3