N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-1-(4-fluoranyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-1-(4-fluoranyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(6-chlorothiochroman-4-yl)-1-(4-fluoro-3-nitro-phenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-(4-fluoro-3-nitrophenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-1-(4-fluoro-3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(6-chlorothiochroman-4-yl)-1-(4-fluoro-3-nitro-phenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C20H17ClFN3O4S MolecularWeight: 449.883083

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC(=O)C3CC(=O)N(C3)C4=CC(=C(C=C4)F)[N+](=O)[O-])C=C(C=C2)Cl

Isomeric SMILES

C1CSC2=C(C1NC(=O)C3CC(=O)N(C3)C4=CC(=C(C=C4)F)[N+](=O)[O-])C=C(C=C2)Cl

InChI

InChI=1S/C20H17ClFN3O4S/c21-12-1-4-18-14(8-12)16(5-6-30-18)23-20(27)11-7-19(26)24(10-11)13-2-3-15(22)17(9-13)25(28)29/h1-4,8-9,11,16H,5-7,10H2,(H,23,27)