5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-6-oxidanyl-1-phenethyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-6-oxidanyl-1-phenethyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-phenethyl-2-thioxo-pyrimidin-4-one CAS Name: 6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-phenethyl-2-sulfanylidene-4-pyrimidinone IUPAC Name: 6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-phenethyl-2-sulfanylidenepyrimidin-4-one Traditional Name: 6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxol[4,5-g]isoquinolin-5-yl)-1-phenethyl-2-thioxo-pyrimidin-4-one Formula: C24H25N3O5S MolecularWeight: 467.5374

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC3=C(C(=C2C1C4=C(N(C(=S)NC4=O)CCC5=CC=CC=C5)O)OC)OCO3

Isomeric SMILES

CN1CCC2=CC3=C(C(=C2C1C4=C(N(C(=S)NC4=O)CCC5=CC=CC=C5)O)OC)OCO3

InChI

InChI=1S/C24H25N3O5S/c1-26-10-9-15-12-16-20(32-13-31-16)21(30-2)17(15)19(26)18-22(28)25-24(33)27(23(18)29)11-8-14-6-4-3-5-7-14/h3-7,12,19,29H,8-11,13H2,1-2H3,(H,25,28,33)