N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-bromanyl-pyridine-3-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-bromanyl-pyridine-3-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-bromo-pyridine-3-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-bromo-3-pyridinecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-5-bromopyridine-3-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-bromo-nicotinamide Formula: C17H17BrN4OS MolecularWeight: 405.31208

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C17H17BrN4OS/c1-24-7-6-15(16-20-13-4-2-3-5-14(13)21-16)22-17(23)11-8-12(18)10-19-9-11/h2-5,8-10,15H,6-7H2,1H3,(H,20,21)(H,22,23)