ethyl 4-[[4-[2-(3-methylphenoxy)ethanoyloxy]phenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[[4-[2-(3-methylphenoxy)ethanoyloxy]phenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-[2-(3-methylphenoxy)acetyl]oxyanilino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[4-[2-(3-methylphenoxy)-1-oxoethoxy]anilino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[2-(3-methylphenoxy)acetyl]oxyanilino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[4-[2-(3-methylphenoxy)acetyl]oxyanilino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)OC(=O)COC3=CC=CC(=C3)C)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)OC(=O)COC3=CC=CC(=C3)C)SC

InChI

InChI=1S/C23H23N3O5S/c1-4-29-22(28)19-13-24-23(32-3)26-21(19)25-16-8-10-17(11-9-16)31-20(27)14-30-18-7-5-6-15(2)12-18/h5-13H,4,14H2,1-3H3,(H,24,25,26)