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5-nitro-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-benzenecarbonitrile

5-nitro-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-benzenecarbonitrile

Systemtic Name:5-nitro-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-benzenecarbonitrile
Openeye Name:5-nitro-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]benzonitrile
CAS Name:5-nitro-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]benzonitrile
IUPAC Name:5-nitro-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbenzonitrile
Traditional Name:5-nitro-2-[[5-(trifluoromethyl)-2-pyridyl]thio]benzonitrile
Formula: C13H6F3N3O2S
MolecularWeight: 325.26585
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

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


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