4-(4-methylphenoxy)-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: 4-(4-methylphenoxy)-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: 4-(4-methylphenoxy)-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(4-methylphenoxy)-2-(methylthio)-5-pyrimidinecarboxylate IUPAC Name: 4-(4-methylphenoxy)-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(4-methylphenoxy)-2-(methylthio)pyrimidine-5-carboxylate Formula: C13H11N2O3S- MolecularWeight: 275.30304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=NC(=NC=C2C(=O)[O-])SC

Isomeric SMILES

CC1=CC=C(C=C1)OC2=NC(=NC=C2C(=O)[O-])SC

InChI

InChI=1S/C13H12N2O3S/c1-8-3-5-9(6-4-8)18-11-10(12(16)17)7-14-13(15-11)19-2/h3-7H,1-2H3,(H,16,17)/p-1