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

Systemtic Name: (2,3-dimethoxy-4-propoxy-5-pyrimidin-4-ylsulfinyl-naphthalen-1-yl) ethanoate Openeye Name: (2,3-dimethoxy-4-propoxy-5-pyrimidin-4-ylsulfinyl-1-naphthyl) acetate CAS Name: acetic acid [2,3-dimethoxy-4-propoxy-5-(4-pyrimidinylsulfinyl)-1-naphthalenyl] ester IUPAC Name: (2,3-dimethoxy-4-propoxy-5-pyrimidin-4-ylsulfinylnaphthalen-1-yl) acetate Traditional Name: acetic acid [2,3-dimethoxy-4-propoxy-5-(4-pyrimidylsulfinyl)-1-naphthyl] ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C(=C(C2=C1C(=CC=C2)S(=O)C3=NC=NC=C3)OC(=O)C)OC)OC

Isomeric SMILES

CCCOC1=C(C(=C(C2=C1C(=CC=C2)S(=O)C3=NC=NC=C3)OC(=O)C)OC)OC

InChI

InChI=1S/C21H22N2O6S/c1-5-11-28-19-17-14(18(29-13(2)24)20(26-3)21(19)27-4)7-6-8-15(17)30(25)16-9-10-22-12-23-16/h6-10,12H,5,11H2,1-4H3