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

Systemtic Name: N-[2,6-bis(bromanyl)-4-methoxy-phenyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-dibromo-4-methoxy-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2,6-dibromo-4-methoxyphenyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(2,6-dibromo-4-methoxyphenyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(2,6-dibromo-4-methoxy-phenyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetamide Formula: C20H17Br2N3O2S MolecularWeight: 523.24088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC3=C(C=C(C=C3Br)OC)Br

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC3=C(C=C(C=C3Br)OC)Br

InChI

InChI=1S/C20H17Br2N3O2S/c1-12-8-17(13-6-4-3-5-7-13)24-20(23-12)28-11-18(26)25-19-15(21)9-14(27-2)10-16(19)22/h3-10H,11H2,1-2H3,(H,25,26)