N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-dibromo-4-methyl-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2,6-dibromo-4-methylphenyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(2,6-dibromo-4-methylphenyl)-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2,6-dibromo-4-methyl-phenyl)-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C13H13Br2N3OS MolecularWeight: 419.13482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NC=CN2C)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NC=CN2C)Br

InChI

InChI=1S/C13H13Br2N3OS/c1-8-5-9(14)12(10(15)6-8)17-11(19)7-20-13-16-3-4-18(13)2/h3-6H,7H2,1-2H3,(H,17,19)