(4-ethylphenyl) 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: (4-ethylphenyl) 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate Openeye Name: (4-ethylphenyl) 5-chloro-2-methylsulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(methylthio)-4-pyrimidinecarboxylic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) 5-chloro-2-methylsulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(methylthio)pyrimidine-4-carboxylic acid (4-ethylphenyl) ester Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C14H13ClN2O2S/c1-3-9-4-6-10(7-5-9)19-13(18)12-11(15)8-16-14(17-12)20-2/h4-8H,3H2,1-2H3