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

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]ethanamide Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]acetamide CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-N-[(4-methoxyphenyl)-(1-methyl-2-imidazolyl)methyl]acetamide IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]acetamide Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]acetamide Formula: C22H24BrN3O2S MolecularWeight: 474.41386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NC(C2=CC=C(C=C2)OC)C3=NC=CN3C

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NC(C2=CC=C(C=C2)OC)C3=NC=CN3C

InChI

InChI=1S/C22H24BrN3O2S/c1-14-12-19(15(2)11-18(14)23)29-13-20(27)25-21(22-24-9-10-26(22)3)16-5-7-17(28-4)8-6-16/h5-12,21H,13H2,1-4H3,(H,25,27)