2-[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxidanidyl-pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: 2-[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxidanidyl-pyrimidin-2-yl]sulfanylethanoate Openeye Name: 2-[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxido-pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxido-2-pyrimidinyl]thio]acetate IUPAC Name: 2-[5-[(4-methoxyphenyl)methyl]-4-methyl-6-oxidopyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[(4-methyl-6-oxido-5-p-anisyl-pyrimidin-2-yl)thio]acetate Formula: C15H14N2O4S-2 MolecularWeight: 318.34766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SCC(=O)[O-])[O-])CC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)SCC(=O)[O-])[O-])CC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H16N2O4S/c1-9-12(7-10-3-5-11(21-2)6-4-10)14(20)17-15(16-9)22-8-13(18)19/h3-6H,7-8H2,1-2H3,(H,18,19)(H,16,17,20)/p-2