3-nitro-6-[3-(trifluoromethyl)phenyl]sulfanyl-pyridine-2-carbonitrile

Systemtic Name: 3-nitro-6-[3-(trifluoromethyl)phenyl]sulfanyl-pyridine-2-carbonitrile Openeye Name: 3-nitro-6-[3-(trifluoromethyl)phenyl]sulfanyl-pyridine-2-carbonitrile CAS Name: 3-nitro-6-[[3-(trifluoromethyl)phenyl]thio]-2-pyridinecarbonitrile IUPAC Name: 3-nitro-6-[3-(trifluoromethyl)phenyl]sulfanylpyridine-2-carbonitrile Traditional Name: 3-nitro-6-[[3-(trifluoromethyl)phenyl]thio]picolinonitrile Formula: C13H6F3N3O2S MolecularWeight: 325.26585

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=NC(=C(C=C2)[N+](=O)[O-])C#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)SC2=NC(=C(C=C2)[N+](=O)[O-])C#N)C(F)(F)F

InChI

InChI=1S/C13H6F3N3O2S/c14-13(15,16)8-2-1-3-9(6-8)22-12-5-4-11(19(20)21)10(7-17)18-12/h1-6H