6-fluoranyl-4-oxidanylidene-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1H-quinoline-3-carboxamide

Systemtic Name: 6-fluoranyl-4-oxidanylidene-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1H-quinoline-3-carboxamide Openeye Name: 6-fluoro-4-oxo-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1H-quinoline-3-carboxamide CAS Name: 6-fluoro-4-oxo-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-1H-quinoline-3-carboxamide IUPAC Name: 6-fluoro-4-oxo-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1H-quinoline-3-carboxamide Traditional Name: 6-fluoro-4-keto-N-(4-pyrrolidinosulfonylphenyl)-1H-quinoline-3-carboxamide Formula: C20H18FN3O4S MolecularWeight: 415.438023

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CNC4=C(C3=O)C=C(C=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CNC4=C(C3=O)C=C(C=C4)F

InChI

InChI=1S/C20H18FN3O4S/c21-13-3-8-18-16(11-13)19(25)17(12-22-18)20(26)23-14-4-6-15(7-5-14)29(27,28)24-9-1-2-10-24/h3-8,11-12H,1-2,9-10H2,(H,22,25)(H,23,26)