5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-6-oxidanyl-2-sulfanylidene-1-[3-(trifluoromethyl)phenyl]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-2-sulfanylidene-1-[3-(trifluoromethyl)phenyl]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)-2-thioxo-1-[3-(trifluoromethyl)phenyl]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)-2-sulfanylidene-1-[3-(trifluoromethyl)phenyl]-4-pyrimidinone IUPAC Name: 6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-2-sulfanylidene-1-[3-(trifluoromethyl)phenyl]pyrimidin-4-one Traditional Name: 6-hydroxy-5-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxol[4,5-g]isoquinolin-5-yl)-2-thioxo-1-[3-(trifluoromethyl)phenyl]pyrimidin-4-one Formula: C23H20F3N3O5S MolecularWeight: 507.48221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20F3N3O5S/c1-28-7-6-11-8-14-18(34-10-33-14)19(32-2)15(11)17(28)16-20(30)27-22(35)29(21(16)31)13-5-3-4-12(9-13)23(24,25)26/h3-5,8-9,17,31H,6-7,10H2,1-2H3,(H,27,30,35)