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

Systemtic Name: 5-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-1-yl)-1-ethyl-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 5-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)-1-ethyl-6-hydroxy-2-thioxo-pyrimidin-4-one CAS Name: 5-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)-1-ethyl-6-hydroxy-2-sulfanylidene-4-pyrimidinone IUPAC Name: 5-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)-1-ethyl-6-hydroxy-2-sulfanylidenepyrimidin-4-one Traditional Name: 5-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)-1-ethyl-6-hydroxy-2-thioxo-pyrimidin-4-one Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)NC1=S)C2C3=CC=CC=C3CCN2C(=O)C)O

Isomeric SMILES

CCN1C(=C(C(=O)NC1=S)C2C3=CC=CC=C3CCN2C(=O)C)O

InChI

InChI=1S/C17H19N3O3S/c1-3-19-16(23)13(15(22)18-17(19)24)14-12-7-5-4-6-11(12)8-9-20(14)10(2)21/h4-7,14,23H,3,8-9H2,1-2H3,(H,18,22,24)