(10aR)-7,8-dimethoxy-2-(3-methylsulfanylphenyl)-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one

Systemtic Name: (10aR)-7,8-dimethoxy-2-(3-methylsulfanylphenyl)-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one Openeye Name: (10aR)-7,8-dimethoxy-2-(3-methylsulfanylphenyl)-3-thioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one CAS Name: (10aR)-7,8-dimethoxy-2-[3-(methylthio)phenyl]-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one IUPAC Name: (10aR)-7,8-dimethoxy-2-(3-methylsulfanylphenyl)-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one Traditional Name: (10aR)-7,8-dimethoxy-2-[3-(methylthio)phenyl]-3-thioxo-10,10a-dihydro-5H-imidaz[1,5-b]isoquinolin-1-one Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN3C(CC2=C1)C(=O)N(C3=S)C4=CC(=CC=C4)SC)OC

Isomeric SMILES

COC1=C(C=C2CN3[C@H](CC2=C1)C(=O)N(C3=S)C4=CC(=CC=C4)SC)OC

InChI

InChI=1S/C20H20N2O3S2/c1-24-17-8-12-7-16-19(23)22(14-5-4-6-15(10-14)27-3)20(26)21(16)11-13(12)9-18(17)25-2/h4-6,8-10,16H,7,11H2,1-3H3/t16-/m1/s1