8-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2,3-dihydrothiochromen-4-one

Systemtic Name: 8-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2,3-dihydrothiochromen-4-one Openeye Name: 8-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiochroman-4-one CAS Name: 8-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2,3-dihydro-1-benzothiopyran-4-one IUPAC Name: 8-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2,3-dihydrothiochromen-4-one Traditional Name: 8-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiochroman-4-one Formula: C19H17NO2S MolecularWeight: 323.40878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=CC4=C3SCCC4=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=CC4=C3SCCC4=O

InChI

InChI=1S/C19H17NO2S/c21-17-9-11-23-18-15(17)6-3-7-16(18)19(22)20-10-8-13-4-1-2-5-14(13)12-20/h1-7H,8-12H2