ethyl 4-(2-bromanyl-4-methanoyl-6-methoxy-phenoxy)-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(2-bromanyl-4-methanoyl-6-methoxy-phenoxy)-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-bromo-4-formyl-6-methoxy-phenoxy)-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(2-bromo-4-formyl-6-methoxyphenoxy)-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-bromo-4-formyl-6-methoxyphenoxy)-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(2-bromo-4-formyl-6-methoxy-phenoxy)-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H15BrN2O5S MolecularWeight: 427.2697

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1OC2=C(C=C(C=C2Br)C=O)OC)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1OC2=C(C=C(C=C2Br)C=O)OC)SC

InChI

InChI=1S/C16H15BrN2O5S/c1-4-23-15(21)10-7-18-16(25-3)19-14(10)24-13-11(17)5-9(8-20)6-12(13)22-2/h5-8H,4H2,1-3H3