methyl 2-[2-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[(3-bromo-4-methoxyphenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[(3-bromo-4-methoxy-benzyl)thio]-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:

COC1=C(C=C(C=C1)CSC2=NC(=O)C=C(N2)CC(=O)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NC(=O)C=C(N2)CC(=O)OC)Br

InChI

InChI=1S/C15H15BrN2O4S/c1-21-12-4-3-9(5-11(12)16)8-23-15-17-10(6-13(19)18-15)7-14(20)22-2/h3-6H,7-8H2,1-2H3,(H,17,18,19)