[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-(4-fluoranyl-1-benzothiophen-2-yl)methanone

Systemtic Name: [(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-(4-fluoranyl-1-benzothiophen-2-yl)methanone Openeye Name: [(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-(4-fluorobenzothiophen-2-yl)methanone CAS Name: [(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-(4-fluoro-1-benzothiophen-2-yl)methanone IUPAC Name: [(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-(4-fluoro-1-benzothiophen-2-yl)methanone Traditional Name: [(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-(4-fluorobenzothiophen-2-yl)methanone Formula: C18H20FNOS MolecularWeight: 317.420903

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2CN(CCC2C1)C(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

C1CC[C@@H]2CN(CC[C@H]2C1)C(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C18H20FNOS/c19-15-6-3-7-16-14(15)10-17(22-16)18(21)20-9-8-12-4-1-2-5-13(12)11-20/h3,6-7,10,12-13H,1-2,4-5,8-9,11H2/t12-,13-/m1/s1