(2E)-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxidanylidene-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-butanenitrile

Systemtic Name: (2E)-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxidanylidene-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-butanenitrile Openeye Name: (2E)-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxo-4-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]butanenitrile CAS Name: (2E)-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxo-4-[[5-(trifluoromethyl)-2-pyridinyl]thio]butanenitrile IUPAC Name: (2E)-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxo-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbutanenitrile Traditional Name: (2E)-3-keto-2-(3-methyl-1H-benzimidazol-2-ylidene)-4-[[5-(trifluoromethyl)-2-pyridyl]thio]butyronitrile Formula: C18H13F3N4OS MolecularWeight: 390.38223

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2NC1=C(C#N)C(=O)CSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN\1C2=CC=CC=C2N/C1=C(/C#N)\C(=O)CSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H13F3N4OS/c1-25-14-5-3-2-4-13(14)24-17(25)12(8-22)15(26)10-27-16-7-6-11(9-23-16)18(19,20)21/h2-7,9,24H,10H2,1H3/b17-12+