methyl 2-[(10aS)-1-oxidanylidene-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]benzoate

Systemtic Name: methyl 2-[(10aS)-1-oxidanylidene-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]benzoate Openeye Name: methyl 2-[(10aS)-1-oxo-3-thioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]benzoate CAS Name: 2-[(10aS)-1-oxo-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[(10aS)-1-oxo-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]benzoate Traditional Name: 2-[(10aS)-1-keto-3-thioxo-10,10a-dihydro-5H-imidaz[1,5-b]isoquinolin-2-yl]benzoic acid methyl ester Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N2C(=O)C3CC4=CC=CC=C4CN3C2=S

Isomeric SMILES

COC(=O)C1=CC=CC=C1N2C(=O)[C@@H]3CC4=CC=CC=C4CN3C2=S

InChI

InChI=1S/C19H16N2O3S/c1-24-18(23)14-8-4-5-9-15(14)21-17(22)16-10-12-6-2-3-7-13(12)11-20(16)19(21)25/h2-9,16H,10-11H2,1H3/t16-/m0/s1