4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-quinolin-2-one

Systemtic Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-quinolin-2-one Openeye Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-1-ethyl-quinolin-2-one CAS Name: 4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-1-ethyl-2-quinolinone IUPAC Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-1-ethylquinolin-2-one Traditional Name: 4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-1-ethyl-carbostyril Formula: C22H22N2O2S MolecularWeight: 378.48728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=CC1=O)SCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCN1C2=CC=CC=C2C(=CC1=O)SCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H22N2O2S/c1-2-24-19-10-6-5-9-18(19)20(13-21(24)25)27-15-22(26)23-12-11-16-7-3-4-8-17(16)14-23/h3-10,13H,2,11-12,14-15H2,1H3