2-bromanyl-6-octylsulfanyl-pyridine-4-carboxamide

Systemtic Name: 2-bromanyl-6-octylsulfanyl-pyridine-4-carboxamide Openeye Name: 2-bromo-6-octylsulfanyl-pyridine-4-carboxamide CAS Name: 2-bromo-6-(octylthio)-4-pyridinecarboxamide IUPAC Name: 2-bromo-6-octylsulfanylpyridine-4-carboxamide Traditional Name: 2-bromo-6-(octylthio)isonicotinamide Formula: C14H21BrN2OS MolecularWeight: 345.29834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NC(=CC(=C1)C(=O)N)Br

Isomeric SMILES

CCCCCCCCSC1=NC(=CC(=C1)C(=O)N)Br

InChI

InChI=1S/C14H21BrN2OS/c1-2-3-4-5-6-7-8-19-13-10-11(14(16)18)9-12(15)17-13/h9-10H,2-8H2,1H3,(H2,16,18)