N-(4-bromanyl-3-methyl-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-(2-pyrimidylthio)acetamide Formula: C13H12BrN3OS MolecularWeight: 338.22288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=NC=CC=N2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=NC=CC=N2)Br

InChI

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