methyl 5-(4-butylsulfanyl-1,2,5-oxadiazol-3-yl)-3-azabicyclo[2.2.2]octane-3-carboxylate

Systemtic Name: methyl 5-(4-butylsulfanyl-1,2,5-oxadiazol-3-yl)-3-azabicyclo[2.2.2]octane-3-carboxylate Openeye Name: methyl 5-(4-butylsulfanyl-1,2,5-oxadiazol-3-yl)-3-azabicyclo[2.2.2]octane-3-carboxylate CAS Name: 5-[4-(butylthio)-1,2,5-oxadiazol-3-yl]-3-azabicyclo[2.2.2]octane-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-butylsulfanyl-1,2,5-oxadiazol-3-yl)-3-azabicyclo[2.2.2]octane-3-carboxylate Traditional Name: 5-[4-(butylthio)furazan-3-yl]-3-azabicyclo[2.2.2]octane-3-carboxylic acid methyl ester Formula: C15H23N3O3S MolecularWeight: 325.42642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NON=C1C2CC3CCC2N(C3)C(=O)OC

Isomeric SMILES

CCCCSC1=NON=C1C2CC3CCC2N(C3)C(=O)OC

InChI

InChI=1S/C15H23N3O3S/c1-3-4-7-22-14-13(16-21-17-14)11-8-10-5-6-12(11)18(9-10)15(19)20-2/h10-12H,3-9H2,1-2H3