5-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-3-[(3-nitrophenyl)methyl]-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-3-[(3-nitrophenyl)methyl]-1,3-thiazolidine-2,4-dione Openeye Name: 5-[(5-fluoro-2-methyl-4-pyrrolidin-1-yl-phenyl)methylene]-3-[(3-nitrophenyl)methyl]thiazolidine-2,4-dione CAS Name: 5-[[5-fluoro-2-methyl-4-(1-pyrrolidinyl)phenyl]methylidene]-3-[(3-nitrophenyl)methyl]thiazolidine-2,4-dione IUPAC Name: 5-[(5-fluoro-2-methyl-4-pyrrolidin-1-ylphenyl)methylidene]-3-[(3-nitrophenyl)methyl]-1,3-thiazolidine-2,4-dione Traditional Name: 5-(5-fluoro-2-methyl-4-pyrrolidino-benzylidene)-3-(3-nitrobenzyl)thiazolidine-2,4-quinone Formula: C22H20FN3O4S MolecularWeight: 441.475303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=C2C(=O)N(C(=O)S2)CC3=CC(=CC=C3)[N+](=O)[O-])F)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1C=C2C(=O)N(C(=O)S2)CC3=CC(=CC=C3)[N+](=O)[O-])F)N4CCCC4

InChI

InChI=1S/C22H20FN3O4S/c1-14-9-19(24-7-2-3-8-24)18(23)11-16(14)12-20-21(27)25(22(28)31-20)13-15-5-4-6-17(10-15)26(29)30/h4-6,9-12H,2-3,7-8,13H2,1H3