(2,3-dimethoxy-4-oxidanyl-5-pyrimidin-4-ylsulfinyl-naphthalen-1-yl) ethanoate

Systemtic Name: (2,3-dimethoxy-4-oxidanyl-5-pyrimidin-4-ylsulfinyl-naphthalen-1-yl) ethanoate Openeye Name: (4-hydroxy-2,3-dimethoxy-5-pyrimidin-4-ylsulfinyl-1-naphthyl) acetate CAS Name: acetic acid [4-hydroxy-2,3-dimethoxy-5-(4-pyrimidinylsulfinyl)-1-naphthalenyl] ester IUPAC Name: (4-hydroxy-2,3-dimethoxy-5-pyrimidin-4-ylsulfinylnaphthalen-1-yl) acetate Traditional Name: acetic acid [4-hydroxy-2,3-dimethoxy-5-(4-pyrimidylsulfinyl)-1-naphthyl] ester Formula: C18H16N2O6S MolecularWeight: 388.39444

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C2=C1C=CC=C2S(=O)C3=NC=NC=C3)O)OC)OC

Isomeric SMILES

CC(=O)OC1=C(C(=C(C2=C1C=CC=C2S(=O)C3=NC=NC=C3)O)OC)OC

InChI

InChI=1S/C18H16N2O6S/c1-10(21)26-16-11-5-4-6-12(27(23)13-7-8-19-9-20-13)14(11)15(22)17(24-2)18(16)25-3/h4-9,22H,1-3H3