methyl 2-(2-acetamido-5-bromanyl-6-methyl-pyrimidin-4-yl)sulfanylethanoate

Systemtic Name: methyl 2-(2-acetamido-5-bromanyl-6-methyl-pyrimidin-4-yl)sulfanylethanoate Openeye Name: methyl 2-(2-acetamido-5-bromo-6-methyl-pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(2-acetamido-5-bromo-6-methyl-4-pyrimidinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(2-acetamido-5-bromo-6-methylpyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(2-acetamido-5-bromo-6-methyl-pyrimidin-4-yl)thio]acetic acid methyl ester Formula: C10H12BrN3O3S MolecularWeight: 334.18958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NC(=O)C)SCC(=O)OC)Br

Isomeric SMILES

CC1=C(C(=NC(=N1)NC(=O)C)SCC(=O)OC)Br

InChI

InChI=1S/C10H12BrN3O3S/c1-5-8(11)9(18-4-7(16)17-3)14-10(12-5)13-6(2)15/h4H2,1-3H3,(H,12,13,14,15)