3-[(3S)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1,1-dithiophen-2-yl-prop-2-yn-1-ol

Systemtic Name: 3-[(3S)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1,1-dithiophen-2-yl-prop-2-yn-1-ol Openeye Name: 3-[(3S)-3-methoxyquinuclidin-3-yl]-1,1-bis(2-thienyl)prop-2-yn-1-ol CAS Name: 3-[(3S)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1,1-dithiophen-2-yl-2-propyn-1-ol IUPAC Name: 3-[(3S)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1,1-dithiophen-2-ylprop-2-yn-1-ol Traditional Name: 3-[(3S)-3-methoxyquinuclidin-3-yl]-1,1-bis(2-thienyl)prop-2-yn-1-ol Formula: C19H21NO2S2 MolecularWeight: 359.50554

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CN2CCC1CC2)C#CC(C3=CC=CS3)(C4=CC=CS4)O

Isomeric SMILES

CO[C@]1(CN2CCC1CC2)C#CC(C3=CC=CS3)(C4=CC=CS4)O

InChI

InChI=1S/C19H21NO2S2/c1-22-18(14-20-10-6-15(18)7-11-20)8-9-19(21,16-4-2-12-23-16)17-5-3-13-24-17/h2-5,12-13,15,21H,6-7,10-11,14H2,1H3/t18-/m0/s1