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

Systemtic Name: ethyl 1-[[5-(2-chlorophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[[5-(2-chlorophenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]piperidine-3-carboxylate CAS Name: 1-[[5-(2-chlorophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[5-(2-chlorophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]piperidine-3-carboxylate Traditional Name: 1-[[5-(2-chlorophenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]nipecotic acid ethyl ester Formula: C17H20ClN3O3S MolecularWeight: 381.877

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CN2C(=S)OC(=N2)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CN2C(=S)OC(=N2)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H20ClN3O3S/c1-2-23-16(22)12-6-5-9-20(10-12)11-21-17(25)24-15(19-21)13-7-3-4-8-14(13)18/h3-4,7-8,12H,2,5-6,9-11H2,1H3