[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate

Systemtic Name: [2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate Openeye Name: [2-(2-ethyl-1-piperidyl)-2-oxo-ethyl] 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate CAS Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzoic acid [2-(2-ethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(2-ethylpiperidin-1-yl)-2-oxoethyl] 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate Traditional Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzoic acid [2-(2-ethylpiperidino)-2-keto-ethyl] ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)COC(=O)C2=CC=CC=C2SCC3=NC(=NO3)C

Isomeric SMILES

CCC1CCCCN1C(=O)COC(=O)C2=CC=CC=C2SCC3=NC(=NO3)C

InChI

InChI=1S/C20H25N3O4S/c1-3-15-8-6-7-11-23(15)19(24)12-26-20(25)16-9-4-5-10-17(16)28-13-18-21-14(2)22-27-18/h4-5,9-10,15H,3,6-8,11-13H2,1-2H3