6-[bis(fluoranyl)methyl]-2-[(4-bromophenyl)methylsulfanyl]-4-methyl-pyridine-3-carbonitrile

Systemtic Name: 6-[bis(fluoranyl)methyl]-2-[(4-bromophenyl)methylsulfanyl]-4-methyl-pyridine-3-carbonitrile Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-6-(difluoromethyl)-4-methyl-pyridine-3-carbonitrile CAS Name: 2-[(4-bromophenyl)methylthio]-6-(difluoromethyl)-4-methyl-3-pyridinecarbonitrile IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile Traditional Name: 2-[(4-bromobenzyl)thio]-6-(difluoromethyl)-4-methyl-nicotinonitrile Formula: C15H11BrF2N2S MolecularWeight: 369.227046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC2=CC=C(C=C2)Br)C(F)F

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC2=CC=C(C=C2)Br)C(F)F

InChI

InChI=1S/C15H11BrF2N2S/c1-9-6-13(14(17)18)20-15(12(9)7-19)21-8-10-2-4-11(16)5-3-10/h2-6,14H,8H2,1H3