2-pyrimidin-2-ylsulfanyl-N-[2,4,6-tris(bromanyl)-3-methoxy-phenyl]ethanamide

Systemtic Name: 2-pyrimidin-2-ylsulfanyl-N-[2,4,6-tris(bromanyl)-3-methoxy-phenyl]ethanamide Openeye Name: 2-pyrimidin-2-ylsulfanyl-N-(2,4,6-tribromo-3-methoxy-phenyl)acetamide CAS Name: 2-(2-pyrimidinylthio)-N-(2,4,6-tribromo-3-methoxyphenyl)acetamide IUPAC Name: 2-pyrimidin-2-ylsulfanyl-N-(2,4,6-tribromo-3-methoxyphenyl)acetamide Traditional Name: 2-(2-pyrimidylthio)-N-(2,4,6-tribromo-3-methoxy-phenyl)acetamide Formula: C13H10Br3N3O2S MolecularWeight: 512.0144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1Br)NC(=O)CSC2=NC=CC=N2)Br)Br

Isomeric SMILES

COC1=C(C=C(C(=C1Br)NC(=O)CSC2=NC=CC=N2)Br)Br

InChI

InChI=1S/C13H10Br3N3O2S/c1-21-12-8(15)5-7(14)11(10(12)16)19-9(20)6-22-13-17-3-2-4-18-13/h2-5H,6H2,1H3,(H,19,20)