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

Systemtic Name: (5E)-3-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: (5E)-3-[(2-chloro-4-fluoro-phenyl)methyl]-5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylene]thiazolidine-2,4-dione CAS Name: (5E)-3-[(2-chloro-4-fluorophenyl)methyl]-5-[[1-(3-nitrophenyl)-3-pyrrolyl]methylidene]thiazolidine-2,4-dione IUPAC Name: (5E)-3-[(2-chloro-4-fluorophenyl)methyl]-5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: (5E)-3-(2-chloro-4-fluoro-benzyl)-5-[[1-(3-nitrophenyl)pyrrol-3-yl]methylene]thiazolidine-2,4-quinone Formula: C21H13ClFN3O4S MolecularWeight: 457.862023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=CC(=C2)C=C3C(=O)N(C(=O)S3)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=CC(=C2)/C=C/3\C(=O)N(C(=O)S3)CC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C21H13ClFN3O4S/c22-18-9-15(23)5-4-14(18)12-25-20(27)19(31-21(25)28)8-13-6-7-24(11-13)16-2-1-3-17(10-16)26(29)30/h1-11H,12H2/b19-8+