1-(4-fluorophenyl)carbonyl-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-quinoline-6-sulfonamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-quinoline-6-sulfonamide Openeye Name: 1-(4-fluorobenzoyl)-N-(3-pyridylmethyl)-3,4-dihydro-2H-quinoline-6-sulfonamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-(3-pyridinylmethyl)-3,4-dihydro-2H-quinoline-6-sulfonamide IUPAC Name: 1-(4-fluorobenzoyl)-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-quinoline-6-sulfonamide Traditional Name: 1-(4-fluorobenzoyl)-N-(3-pyridylmethyl)-3,4-dihydro-2H-quinoline-6-sulfonamide Formula: C22H20FN3O3S MolecularWeight: 425.475903

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)S(=O)(=O)NCC3=CN=CC=C3)N(C1)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC2=C(C=CC(=C2)S(=O)(=O)NCC3=CN=CC=C3)N(C1)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN3O3S/c23-19-7-5-17(6-8-19)22(27)26-12-2-4-18-13-20(9-10-21(18)26)30(28,29)25-15-16-3-1-11-24-14-16/h1,3,5-11,13-14,25H,2,4,12,15H2