2-chloranyl-5-nitro-N-[3-[[3-(trifluoromethyl)pyridin-2-yl]sulfinylamino]propyl]benzamide

Systemtic Name: 2-chloranyl-5-nitro-N-[3-[[3-(trifluoromethyl)pyridin-2-yl]sulfinylamino]propyl]benzamide Openeye Name: 2-chloro-5-nitro-N-[3-[[3-(trifluoromethyl)-2-pyridyl]sulfinylamino]propyl]benzamide CAS Name: 2-chloro-5-nitro-N-[3-[[3-(trifluoromethyl)-2-pyridinyl]sulfinylamino]propyl]benzamide IUPAC Name: 2-chloro-5-nitro-N-[3-[[3-(trifluoromethyl)pyridin-2-yl]sulfinylamino]propyl]benzamide Traditional Name: 2-chloro-5-nitro-N-[3-[[3-(trifluoromethyl)-2-pyridyl]sulfinylamino]propyl]benzamide Formula: C16H14ClF3N4O4S MolecularWeight: 450.81997

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)S(=O)NCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(F)(F)F

Isomeric SMILES

C1=CC(=C(N=C1)S(=O)NCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(F)(F)F

InChI

InChI=1S/C16H14ClF3N4O4S/c17-13-5-4-10(24(26)27)9-11(13)14(25)21-7-2-8-23-29(28)15-12(16(18,19)20)3-1-6-22-15/h1,3-6,9,23H,2,7-8H2,(H,21,25)