N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-(4-fluoranyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-(4-fluoranyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-1-(4-fluoro-3-nitro-phenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-1-(4-fluoro-3-nitrophenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-(4-fluoro-3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-1-(4-fluoro-3-nitro-phenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C22H19FN4O6S MolecularWeight: 486.472863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3CC(=O)N(C3)C4=CC(=C(C=C4)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3CC(=O)N(C3)C4=CC(=C(C=C4)F)[N+](=O)[O-])OC

InChI

InChI=1S/C22H19FN4O6S/c1-32-18-6-3-12(7-19(18)33-2)16-11-34-22(24-16)25-21(29)13-8-20(28)26(10-13)14-4-5-15(23)17(9-14)27(30)31/h3-7,9,11,13H,8,10H2,1-2H3,(H,24,25,29)