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

Systemtic Name: (4-acetyloxy-2,3-dimethoxy-5-pyrimidin-4-ylsulfinyl-naphthalen-1-yl) ethanoate Openeye Name: (4-acetoxy-2,3-dimethoxy-5-pyrimidin-4-ylsulfinyl-1-naphthyl) acetate CAS Name: acetic acid [4-acetyloxy-2,3-dimethoxy-5-(4-pyrimidinylsulfinyl)-1-naphthalenyl] ester IUPAC Name: (4-acetyloxy-2,3-dimethoxy-5-pyrimidin-4-ylsulfinylnaphthalen-1-yl) acetate Traditional Name: acetic acid [4-acetoxy-2,3-dimethoxy-5-(4-pyrimidylsulfinyl)-1-naphthyl] ester Formula: C20H18N2O7S MolecularWeight: 430.43112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O7S/c1-11(23)28-17-13-6-5-7-14(30(25)15-8-9-21-10-22-15)16(13)18(29-12(2)24)20(27-4)19(17)26-3/h5-10H,1-4H3