3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-oxidanylidene-5-(trifluoromethyl)-1H-pyridin-3-yl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-oxidanylidene-5-(trifluoromethyl)-1H-pyridin-3-yl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-keto-5-(trifluoromethyl)-1H-pyridin-3-yl]benzamide Formula: C19H19ClF3N3O4S MolecularWeight: 477.88507

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CNC3=O)C(F)(F)F)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CNC3=O)C(F)(F)F)Cl

InChI

InChI=1S/C19H19ClF3N3O4S/c20-14-6-5-12(9-16(14)31(29,30)26-7-3-1-2-4-8-26)17(27)25-15-10-13(19(21,22)23)11-24-18(15)28/h5-6,9-11H,1-4,7-8H2,(H,24,28)(H,25,27)