N-[[2,4-bis(fluoranyl)phenyl]methyl]-N-methyl-6-morpholin-4-ylsulfonyl-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[[2,4-bis(fluoranyl)phenyl]methyl]-N-methyl-6-morpholin-4-ylsulfonyl-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[(2,4-difluorophenyl)methyl]-N-methyl-6-morpholinosulfonyl-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[(2,4-difluorophenyl)methyl]-N-methyl-6-(4-morpholinylsulfonyl)-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[(2,4-difluorophenyl)methyl]-N-methyl-6-morpholin-4-ylsulfonyl-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-(2,4-difluorobenzyl)-2-keto-N-methyl-6-morpholinosulfonyl-1H-quinoline-4-carboxamide Formula: C22H21F2N3O5S MolecularWeight: 477.481046

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=C(C=C1)F)F)C(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN(CC1=C(C=C(C=C1)F)F)C(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H21F2N3O5S/c1-26(13-14-2-3-15(23)10-19(14)24)22(29)18-12-21(28)25-20-5-4-16(11-17(18)20)33(30,31)27-6-8-32-9-7-27/h2-5,10-12H,6-9,13H2,1H3,(H,25,28)