ethyl 4-[[3-[4-(2-methylpropoxy)phenyl]carbonyloxyphenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[[3-[4-(2-methylpropoxy)phenyl]carbonyloxyphenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[3-(4-isobutoxybenzoyl)oxyanilino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[3-[[4-(2-methylpropoxy)phenyl]-oxomethoxy]anilino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[4-(2-methylpropoxy)benzoyl]oxyanilino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[3-(4-isobutoxybenzoyl)oxyanilino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O5S/c1-5-31-24(30)21-14-26-25(34-4)28-22(21)27-18-7-6-8-20(13-18)33-23(29)17-9-11-19(12-10-17)32-15-16(2)3/h6-14,16H,5,15H2,1-4H3,(H,26,27,28)