ethyl 4-[[4-(furan-2-ylcarbonyloxy)phenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[[4-(furan-2-ylcarbonyloxy)phenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-(furan-2-carbonyloxy)anilino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[4-[2-furanyl(oxo)methoxy]anilino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(furan-2-carbonyloxy)anilino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[4-(2-furoyloxy)anilino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)OC(=O)C3=CC=CO3)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)OC(=O)C3=CC=CO3)SC

InChI

InChI=1S/C19H17N3O5S/c1-3-25-17(23)14-11-20-19(28-2)22-16(14)21-12-6-8-13(9-7-12)27-18(24)15-5-4-10-26-15/h4-11H,3H2,1-2H3,(H,20,21,22)