1-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-imidazole-4,5-dicarbonitrile

Systemtic Name: 1-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-imidazole-4,5-dicarbonitrile Openeye Name: 1-methyl-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]imidazole-4,5-dicarbonitrile CAS Name: 1-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]imidazole-4,5-dicarbonitrile IUPAC Name: 1-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylimidazole-4,5-dicarbonitrile Traditional Name: 1-methyl-2-[[5-(trifluoromethyl)-2-pyridyl]thio]imidazole-4,5-dicarbonitrile Formula: C12H6F3N5S MolecularWeight: 309.26975

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1SC2=NC=C(C=C2)C(F)(F)F)C#N)C#N

Isomeric SMILES

CN1C(=C(N=C1SC2=NC=C(C=C2)C(F)(F)F)C#N)C#N

InChI

InChI=1S/C12H6F3N5S/c1-20-9(5-17)8(4-16)19-11(20)21-10-3-2-7(6-18-10)12(13,14)15/h2-3,6H,1H3