4-[2-(5-pyrrolidin-1-ylcarbonylpyridin-2-yl)sulfanylpropanoyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-(5-pyrrolidin-1-ylcarbonylpyridin-2-yl)sulfanylpropanoyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[[5-(pyrrolidine-1-carbonyl)-2-pyridyl]sulfanyl]propanoyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one CAS Name: 4-[1-oxo-2-[[5-[oxo(1-pyrrolidinyl)methyl]-2-pyridinyl]thio]propyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[5-(pyrrolidine-1-carbonyl)pyridin-2-yl]sulfanylpropanoyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[[5-(pyrrolidine-1-carbonyl)-2-pyridyl]thio]propanoyl]-7-(trifluoromethyl)-1,3-dihydroquinoxalin-2-one Formula: C22H21F3N4O3S MolecularWeight: 478.48735

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=C1C=CC(=C2)C(F)(F)F)SC3=NC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC(C(=O)N1CC(=O)NC2=C1C=CC(=C2)C(F)(F)F)SC3=NC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C22H21F3N4O3S/c1-13(33-19-7-4-14(11-26-19)21(32)28-8-2-3-9-28)20(31)29-12-18(30)27-16-10-15(22(23,24)25)5-6-17(16)29/h4-7,10-11,13H,2-3,8-9,12H2,1H3,(H,27,30)