2-[[1-[bis(fluoranyl)methyl]imidazol-2-yl]methylsulfanyl]-5-ethanoyl-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-[[1-[bis(fluoranyl)methyl]imidazol-2-yl]methylsulfanyl]-5-ethanoyl-6-methyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-2-[[1-(difluoromethyl)imidazol-2-yl]methylsulfanyl]-6-methyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-2-[[1-(difluoromethyl)-2-imidazolyl]methylthio]-6-methyl-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-2-[[1-(difluoromethyl)imidazol-2-yl]methylsulfanyl]-6-methylpyridine-3-carbonitrile Traditional Name: 5-acetyl-2-[[1-(difluoromethyl)imidazol-2-yl]methylthio]-6-methyl-nicotinonitrile Formula: C14H12F2N4OS MolecularWeight: 322.333086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC2=NC=CN2C(F)F)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC2=NC=CN2C(F)F)C#N)C(=O)C

InChI

InChI=1S/C14H12F2N4OS/c1-8-11(9(2)21)5-10(6-17)13(19-8)22-7-12-18-3-4-20(12)14(15)16/h3-5,14H,7H2,1-2H3