N-(4-bromanyl-2-methyl-phenyl)-2-[methyl(2-pyridin-2-ylsulfanylethanoyl)amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[methyl(2-pyridin-2-ylsulfanylethanoyl)amino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[methyl-[2-(2-pyridylsulfanyl)acetyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[methyl-[1-oxo-2-(2-pyridinylthio)ethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[methyl-(2-pyridin-2-ylsulfanylacetyl)amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[methyl-[2-(2-pyridylthio)acetyl]amino]acetamide Formula: C17H18BrN3O2S MolecularWeight: 408.31272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CSC2=CC=CC=N2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CSC2=CC=CC=N2

InChI

InChI=1S/C17H18BrN3O2S/c1-12-9-13(18)6-7-14(12)20-15(22)10-21(2)17(23)11-24-16-5-3-4-8-19-16/h3-9H,10-11H2,1-2H3,(H,20,22)