(4-methoxycarbonylphenyl)methyl 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl)methyl 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate Openeye Name: (4-methoxycarbonylphenyl)methyl 5-chloro-2-methylsulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(methylthio)-4-pyrimidinecarboxylic acid (4-methoxycarbonylphenyl)methyl ester IUPAC Name: (4-methoxycarbonylphenyl)methyl 5-chloro-2-methylsulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(methylthio)pyrimidine-4-carboxylic acid (4-carbomethoxybenzyl) ester Formula: C15H13ClN2O4S MolecularWeight: 352.79272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C15H13ClN2O4S/c1-21-13(19)10-5-3-9(4-6-10)8-22-14(20)12-11(16)7-17-15(18-12)23-2/h3-7H,8H2,1-2H3