N-(5-bromanylpyrimidin-2-yl)-2-(2-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(5-bromanylpyrimidin-2-yl)-2-(2-methylphenyl)sulfanyl-ethanamide Openeye Name: N-(5-bromopyrimidin-2-yl)-2-(o-tolylsulfanyl)acetamide CAS Name: N-(5-bromo-2-pyrimidinyl)-2-[(2-methylphenyl)thio]acetamide IUPAC Name: N-(5-bromopyrimidin-2-yl)-2-(2-methylphenyl)sulfanylacetamide Traditional Name: N-(5-bromopyrimidin-2-yl)-2-(o-tolylthio)acetamide Formula: C13H12BrN3OS MolecularWeight: 338.22288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NC2=NC=C(C=N2)Br

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NC2=NC=C(C=N2)Br

InChI

InChI=1S/C13H12BrN3OS/c1-9-4-2-3-5-11(9)19-8-12(18)17-13-15-6-10(14)7-16-13/h2-7H,8H2,1H3,(H,15,16,17,18)