methyl 2-[2-[2-(4-bromanylphenoxy)ethylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-(4-bromanylphenoxy)ethylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-(4-bromophenoxy)ethylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[2-(4-bromophenoxy)ethylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(4-bromophenoxy)ethylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[2-(4-bromophenoxy)ethylthio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C15H15BrN2O4S MolecularWeight: 399.2596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCCOC2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H15BrN2O4S/c1-21-14(20)9-11-8-13(19)18-15(17-11)23-7-6-22-12-4-2-10(16)3-5-12/h2-5,8H,6-7,9H2,1H3,(H,17,18,19)