3-(1-azabicyclo[2.2.2]octan-3-yl)-4-[(4-ethylphenyl)methoxy]-1,2,5-thiadiazole; ethanedioic acid

Systemtic Name: 3-(1-azabicyclo[2.2.2]octan-3-yl)-4-[(4-ethylphenyl)methoxy]-1,2,5-thiadiazole; ethanedioic acid Openeye Name: 3-[(4-ethylphenyl)methoxy]-4-quinuclidin-3-yl-1,2,5-thiadiazole; oxalic acid CAS Name: 3-(1-azabicyclo[2.2.2]octan-3-yl)-4-[(4-ethylphenyl)methoxy]-1,2,5-thiadiazole; oxalic acid IUPAC Name: 3-(1-azabicyclo[2.2.2]octan-3-yl)-4-[(4-ethylphenyl)methoxy]-1,2,5-thiadiazole; oxalic acid Traditional Name: 3-(4-ethylbenzyl)oxy-4-quinuclidin-3-yl-1,2,5-thiadiazole; oxalic acid Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)COC2=NSN=C2C3CN4CCC3CC4.C(=O)(C(=O)O)O

Isomeric SMILES

CCC1=CC=C(C=C1)COC2=NSN=C2C3CN4CCC3CC4.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H23N3OS.C2H2O4/c1-2-13-3-5-14(6-4-13)12-22-18-17(19-23-20-18)16-11-21-9-7-15(16)8-10-21;3-1(4)2(5)6/h3-6,15-16H,2,7-12H2,1H3;(H,3,4)(H,5,6)