6-methyl-2-[(2-nitrophenyl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-methyl-2-[(2-nitrophenyl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-methyl-2-[(2-nitrophenyl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-methyl-2-[(2-nitrophenyl)methylthio]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-methyl-2-[(2-nitrophenyl)methylsulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-methyl-2-[(2-nitrobenzyl)thio]-4-(trifluoromethyl)nicotinonitrile Formula: C15H10F3N3O2S MolecularWeight: 353.31901

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H10F3N3O2S/c1-9-6-12(15(16,17)18)11(7-19)14(20-9)24-8-10-4-2-3-5-13(10)21(22)23/h2-6H,8H2,1H3