2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-(1-pyridin-2-ylethyl)ethanamide

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-(1-pyridin-2-ylethyl)ethanamide Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-N-[1-(2-pyridyl)ethyl]acetamide CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-N-[1-(2-pyridinyl)ethyl]acetamide IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-(1-pyridin-2-ylethyl)acetamide Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-N-[1-(2-pyridyl)ethyl]acetamide Formula: C17H19BrN2OS MolecularWeight: 379.31456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NC(C)C2=CC=CC=N2

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NC(C)C2=CC=CC=N2

InChI

InChI=1S/C17H19BrN2OS/c1-11-9-16(12(2)8-14(11)18)22-10-17(21)20-13(3)15-6-4-5-7-19-15/h4-9,13H,10H2,1-3H3,(H,20,21)