2-[bis(fluoranyl)methylsulfanyl]-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]pyridine-3-carboxamide

Systemtic Name: 2-[bis(fluoranyl)methylsulfanyl]-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]pyridine-3-carboxamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(difluoromethylsulfanyl)pyridine-3-carboxamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-2-(difluoromethylthio)-3-pyridinecarboxamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(difluoromethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(difluoromethylthio)nicotinamide Formula: C20H23F2N5OS MolecularWeight: 419.491326

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=C(N=CC=C3)SC(F)F

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=C(N=CC=C3)SC(F)F

InChI

InChI=1S/C20H23F2N5OS/c1-3-26(4-2)12-13-27-16-10-6-5-9-15(16)24-20(27)25-17(28)14-8-7-11-23-18(14)29-19(21)22/h5-11,19H,3-4,12-13H2,1-2H3,(H,24,25,28)