ethyl 4-azanyl-2-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-(2-bromo-4-chloro-phenoxy)ethylsulfanyl]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[2-(2-bromo-4-chlorophenoxy)ethylthio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-(2-bromo-4-chlorophenoxy)ethylsulfanyl]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[2-(2-bromo-4-chloro-phenoxy)ethylthio]pyrimidine-5-carboxylic acid ethyl ester Formula: C15H15BrClN3O3S MolecularWeight: 432.7199

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCCOC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCCOC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C15H15BrClN3O3S/c1-2-22-14(21)10-8-19-15(20-13(10)18)24-6-5-23-12-4-3-9(17)7-11(12)16/h3-4,7-8H,2,5-6H2,1H3,(H2,18,19,20)