N-(4-nitrophenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(4-nitrophenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(4-nitrophenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-(4-nitrophenyl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(4-nitrophenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(4-nitrophenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]propionamide Formula: C15H12F3N3O3S MolecularWeight: 371.33429

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C15H12F3N3O3S/c1-9(25-13-7-2-10(8-19-13)15(16,17)18)14(22)20-11-3-5-12(6-4-11)21(23)24/h2-9H,1H3,(H,20,22)