[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [1-(difluoromethyl)benzimidazol-2-yl]methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [1-(difluoromethyl)-2-benzimidazolyl]methyl ester IUPAC Name: [1-(difluoromethyl)benzimidazol-2-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [1-(difluoromethyl)benzimidazol-2-yl]methyl ester Formula: C16H13F2N3O2S MolecularWeight: 349.355126

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC2=NC3=CC=CC=C3N2C(F)F

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC2=NC3=CC=CC=C3N2C(F)F

InChI

InChI=1S/C16H13F2N3O2S/c1-24-14-10(5-4-8-19-14)15(22)23-9-13-20-11-6-2-3-7-12(11)21(13)16(17)18/h2-8,16H,9H2,1H3