2-[2-[2-(4-ethanoylphenoxy)ethoxy]ethylsulfanyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[2-(4-ethanoylphenoxy)ethoxy]ethylsulfanyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[2-[2-(4-acetylphenoxy)ethoxy]ethylsulfanyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[2-[2-(4-acetylphenoxy)ethoxy]ethylthio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-[2-(4-acetylphenoxy)ethoxy]ethylsulfanyl]-6-methylpyrimidin-4-olate Traditional Name: 2-[2-[2-(4-acetylphenoxy)ethoxy]ethylthio]-6-methyl-pyrimidin-4-olate Formula: C17H19N2O4S- MolecularWeight: 347.40876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCOCCOC2=CC=C(C=C2)C(=O)C)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCCOCCOC2=CC=C(C=C2)C(=O)C)[O-]

InChI

InChI=1S/C17H20N2O4S/c1-12-11-16(21)19-17(18-12)24-10-9-22-7-8-23-15-5-3-14(4-6-15)13(2)20/h3-6,11H,7-10H2,1-2H3,(H,18,19,21)/p-1