N-(2-bromanyl-4,5-dimethyl-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-bromanyl-4,5-dimethyl-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-bromo-4,5-dimethyl-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2-bromo-4,5-dimethylphenyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(2-bromo-4,5-dimethylphenyl)-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2-bromo-4,5-dimethyl-phenyl)-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C14H16BrN3OS MolecularWeight: 354.26534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)Br)NC(=O)CSC2=NC=CN2C

Isomeric SMILES

CC1=CC(=C(C=C1C)Br)NC(=O)CSC2=NC=CN2C

InChI

InChI=1S/C14H16BrN3OS/c1-9-6-11(15)12(7-10(9)2)17-13(19)8-20-14-16-4-5-18(14)3/h4-7H,8H2,1-3H3,(H,17,19)