2-chloranyl-N-[2-(2-methylsulfanylethanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide

Systemtic Name: 2-chloranyl-N-[2-(2-methylsulfanylethanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: 2-chloro-N-[2-(2-methylsulfanylacetyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide CAS Name: 2-chloro-N-[2-[2-(methylthio)-1-oxoethyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 2-chloro-N-[2-(2-methylsulfanylacetyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Traditional Name: 2-chloro-N-[2-[2-(methylthio)acetyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Formula: C19H19ClN2O2S MolecularWeight: 374.88436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CSCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H19ClN2O2S/c1-25-12-18(23)22-9-8-13-6-7-15(10-14(13)11-22)21-19(24)16-4-2-3-5-17(16)20/h2-7,10H,8-9,11-12H2,1H3,(H,21,24)