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

Systemtic Name: N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-2-oxidanylidene-6-piperidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Openeye Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-2-oxo-6-(1-piperidylsulfonyl)-1H-quinoline-4-carboxamide CAS Name: N-[(2-chloro-4-fluorophenyl)methyl]-2-oxo-6-(1-piperidinylsulfonyl)-1H-quinoline-4-carboxamide IUPAC Name: N-[(2-chloro-4-fluorophenyl)methyl]-2-oxo-6-piperidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Traditional Name: N-(2-chloro-4-fluoro-benzyl)-2-keto-6-piperidinosulfonyl-1H-quinoline-4-carboxamide Formula: C22H21ClFN3O4S MolecularWeight: 477.936243

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C22H21ClFN3O4S/c23-19-10-15(24)5-4-14(19)13-25-22(29)18-12-21(28)26-20-7-6-16(11-17(18)20)32(30,31)27-8-2-1-3-9-27/h4-7,10-12H,1-3,8-9,13H2,(H,25,29)(H,26,28)