tert-butyl 2-(3-bromanyl-6-methylsulfanyl-2-oxidanylidene-pyrazin-1-yl)ethanoate

Systemtic Name: tert-butyl 2-(3-bromanyl-6-methylsulfanyl-2-oxidanylidene-pyrazin-1-yl)ethanoate Openeye Name: tert-butyl 2-(3-bromo-6-methylsulfanyl-2-oxo-pyrazin-1-yl)acetate CAS Name: 2-[3-bromo-6-(methylthio)-2-oxo-1-pyrazinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-bromo-6-methylsulfanyl-2-oxopyrazin-1-yl)acetate Traditional Name: 2-[3-bromo-2-keto-6-(methylthio)pyrazin-1-yl]acetic acid tert-butyl ester Formula: C11H15BrN2O3S MolecularWeight: 335.2174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C(=CN=C(C1=O)Br)SC

Isomeric SMILES

CC(C)(C)OC(=O)CN1C(=CN=C(C1=O)Br)SC

InChI

InChI=1S/C11H15BrN2O3S/c1-11(2,3)17-8(15)6-14-7(18-4)5-13-9(12)10(14)16/h5H,6H2,1-4H3