2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)-4-methyl-6-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)-4-methyl-6-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)-4-methyl-6-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-(2,1,3-benzoxadiazol-5-ylmethylthio)-4-methyl-6-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)-4-methyl-6-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-(benzofurazan-5-ylmethylthio)-4-methyl-6-(trifluoromethyl)nicotinonitrile Formula: C15H9F3N4OS MolecularWeight: 350.31837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC2=CC3=NON=C3C=C2)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC2=CC3=NON=C3C=C2)C(F)(F)F

InChI

InChI=1S/C15H9F3N4OS/c1-8-4-13(15(16,17)18)20-14(10(8)6-19)24-7-9-2-3-11-12(5-9)22-23-21-11/h2-5H,7H2,1H3