N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(2,6-dibromo-4-methyl-phenyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(2,6-dibromo-4-methylphenyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(2,6-dibromo-4-methylphenyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(2,6-dibromo-4-methyl-phenyl)-2-(2-pyrimidylthio)acetamide Formula: C13H11Br2N3OS MolecularWeight: 417.11894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11Br2N3OS/c1-8-5-9(14)12(10(15)6-8)18-11(19)7-20-13-16-3-2-4-17-13/h2-6H,7H2,1H3,(H,18,19)