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

Systemtic Name: N-[2,6-bis(bromanyl)-4-methoxy-phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(2,6-dibromo-4-methoxy-phenyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(2,6-dibromo-4-methoxyphenyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(2,6-dibromo-4-methoxyphenyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(2,6-dibromo-4-methoxy-phenyl)-2-(2-pyrimidylthio)acetamide Formula: C13H11Br2N3O2S MolecularWeight: 433.11834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NC=CC=N2)Br

Isomeric SMILES

COC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NC=CC=N2)Br

InChI

InChI=1S/C13H11Br2N3O2S/c1-20-8-5-9(14)12(10(15)6-8)18-11(19)7-21-13-16-3-2-4-17-13/h2-6H,7H2,1H3,(H,18,19)