N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-[4-(2-oxo-1-pyrrolidinyl)phenyl]-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-[4-(2-ketopyrrolidino)phenyl]-2-[[5-(trifluoromethyl)-2-pyridyl]thio]propionamide Formula: C19H18F3N3O2S MolecularWeight: 409.42533

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCCC2=O)SC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCCC2=O)SC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H18F3N3O2S/c1-12(28-16-9-4-13(11-23-16)19(20,21)22)18(27)24-14-5-7-15(8-6-14)25-10-2-3-17(25)26/h4-9,11-12H,2-3,10H2,1H3,(H,24,27)