5-(2-ethanoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)-6-oxidanyl-1,3-diphenyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 5-(2-ethanoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)-6-oxidanyl-1,3-diphenyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 5-(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)-6-hydroxy-1,3-diphenyl-2-thioxo-pyrimidin-4-one CAS Name: 5-(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)-6-hydroxy-1,3-diphenyl-2-sulfanylidene-4-pyrimidinone IUPAC Name: 5-(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)-6-hydroxy-1,3-diphenyl-2-sulfanylidenepyrimidin-4-one Traditional Name: 5-(2-acetyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)-6-hydroxy-1,3-diphenyl-2-thioxo-pyrimidin-4-one Formula: C29H27N3O5S MolecularWeight: 529.60678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC(=C(C=C2C1C3=C(N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)O)OC)OC

Isomeric SMILES

CC(=O)N1CCC2=CC(=C(C=C2C1C3=C(N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)O)OC)OC

InChI

InChI=1S/C29H27N3O5S/c1-18(33)30-15-14-19-16-23(36-2)24(37-3)17-22(19)26(30)25-27(34)31(20-10-6-4-7-11-20)29(38)32(28(25)35)21-12-8-5-9-13-21/h4-13,16-17,26,34H,14-15H2,1-3H3