2-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-6-methyl-5-phenoxy-pyrimidin-4-olate

Systemtic Name: 2-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-6-methyl-5-phenoxy-pyrimidin-4-olate Openeye Name: 2-(2-methoxy-2-oxo-ethyl)sulfanyl-6-methyl-5-phenoxy-pyrimidin-4-olate CAS Name: 2-[(2-methoxy-2-oxoethyl)thio]-6-methyl-5-phenoxy-4-pyrimidinolate IUPAC Name: 2-(2-methoxy-2-oxoethyl)sulfanyl-6-methyl-5-phenoxypyrimidin-4-olate Traditional Name: 2-[(2-keto-2-methoxy-ethyl)thio]-6-methyl-5-phenoxy-pyrimidin-4-olate Formula: C14H13N2O4S- MolecularWeight: 305.32902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SCC(=O)OC)[O-])OC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NC(=N1)SCC(=O)OC)[O-])OC2=CC=CC=C2

InChI

InChI=1S/C14H14N2O4S/c1-9-12(20-10-6-4-3-5-7-10)13(18)16-14(15-9)21-8-11(17)19-2/h3-7H,8H2,1-2H3,(H,15,16,18)/p-1