methyl 2-[(5-bromanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(5-bromanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(5-bromo-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[(5-bromo-6-oxo-1H-pyrimidin-2-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(5-bromo-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(5-bromo-6-keto-1H-pyrimidin-2-yl)thio]acetic acid methyl ester Formula: C7H7BrN2O3S MolecularWeight: 279.11108

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC=C(C(=O)N1)Br

Isomeric SMILES

COC(=O)CSC1=NC=C(C(=O)N1)Br

InChI

InChI=1S/C7H7BrN2O3S/c1-13-5(11)3-14-7-9-2-4(8)6(12)10-7/h2H,3H2,1H3,(H,9,10,12)