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

Systemtic Name: ethyl 4-[[3-[2-(4-methoxyphenyl)ethanoyloxy]phenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[3-[2-(4-methoxyphenyl)acetyl]oxyanilino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[3-[2-(4-methoxyphenyl)-1-oxoethoxy]anilino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[2-(4-methoxyphenyl)acetyl]oxyanilino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[3-[2-(4-methoxyphenyl)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(=CC=C2)OC(=O)CC3=CC=C(C=C3)OC)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC(=CC=C2)OC(=O)CC3=CC=C(C=C3)OC)SC

InChI

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