diethoxy-[1-[(phenylmethylsulfanyl)methylidene]-3,4-dihydroisoquinolin-2-yl]-sulfanylidene-$l^{5}-phosphane

Systemtic Name: diethoxy-[1-[(phenylmethylsulfanyl)methylidene]-3,4-dihydroisoquinolin-2-yl]-sulfanylidene-$l^{5}-phosphane Openeye Name: [1-(benzylsulfanylmethylene)-3,4-dihydroisoquinolin-2-yl]-diethoxy-thioxo-$l^{5}-phosphane CAS Name: diethoxy-[1-[(phenylmethylthio)methylidene]-3,4-dihydroisoquinolin-2-yl]-sulfanylidenephosphorane IUPAC Name: [1-(benzylsulfanylmethylidene)-3,4-dihydroisoquinolin-2-yl]-diethoxy-sulfanylidene-$l^{5}-phosphane Traditional Name: [1-[(benzylthio)methylene]-3,4-dihydroisoquinolin-2-yl]-diethoxy-thioxo-phosphorane Formula: C21H26NO2PS2 MolecularWeight: 419.540401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(N1CCC2=CC=CC=C2C1=CSCC3=CC=CC=C3)OCC

Isomeric SMILES

CCOP(=S)(N1CCC2=CC=CC=C2C1=CSCC3=CC=CC=C3)OCC

InChI

InChI=1S/C21H26NO2PS2/c1-3-23-25(26,24-4-2)22-15-14-19-12-8-9-13-20(19)21(22)17-27-16-18-10-6-5-7-11-18/h5-13,17H,3-4,14-16H2,1-2H3