N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide

Systemtic Name: N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Openeye Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-2-oxo-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide CAS Name: N-[(2-chloro-4-fluorophenyl)methyl]-2-oxo-6-(1-pyrrolidinylsulfonyl)-1H-quinoline-4-carboxamide IUPAC Name: N-[(2-chloro-4-fluorophenyl)methyl]-2-oxo-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Traditional Name: N-(2-chloro-4-fluoro-benzyl)-2-keto-6-pyrrolidinosulfonyl-1H-quinoline-4-carboxamide Formula: C21H19ClFN3O4S MolecularWeight: 463.909663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C21H19ClFN3O4S/c22-18-9-14(23)4-3-13(18)12-24-21(28)17-11-20(27)25-19-6-5-15(10-16(17)19)31(29,30)26-7-1-2-8-26/h3-6,9-11H,1-2,7-8,12H2,(H,24,28)(H,25,27)