methyl 2-[4-(4-bromanylpyrazol-1-yl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[4-(4-bromanylpyrazol-1-yl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[4-(4-bromopyrazol-1-yl)pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-(4-bromo-1-pyrazolyl)-2-pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-bromopyrazol-1-yl)pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(4-bromopyrazol-1-yl)pyrimidin-2-yl]thio]acetic acid methyl ester Formula: C10H9BrN4O2S MolecularWeight: 329.17306

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC=CC(=N1)N2C=C(C=N2)Br

Isomeric SMILES

COC(=O)CSC1=NC=CC(=N1)N2C=C(C=N2)Br

InChI

InChI=1S/C10H9BrN4O2S/c1-17-9(16)6-18-10-12-3-2-8(14-10)15-5-7(11)4-13-15/h2-5H,6H2,1H3