4-(5-bromanylpyridin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)butanamide

Systemtic Name: 4-(5-bromanylpyridin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)butanamide Openeye Name: 4-[(5-bromo-2-pyridyl)sulfanyl]-N-(2,6-dimethylphenyl)butanamide CAS Name: 4-[(5-bromo-2-pyridinyl)thio]-N-(2,6-dimethylphenyl)butanamide IUPAC Name: 4-(5-bromopyridin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)butanamide Traditional Name: 4-[(5-bromo-2-pyridyl)thio]-N-(2,6-dimethylphenyl)butyramide Formula: C17H19BrN2OS MolecularWeight: 379.31456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=NC=C(C=C2)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=NC=C(C=C2)Br

InChI

InChI=1S/C17H19BrN2OS/c1-12-5-3-6-13(2)17(12)20-15(21)7-4-10-22-16-9-8-14(18)11-19-16/h3,5-6,8-9,11H,4,7,10H2,1-2H3,(H,20,21)