N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-4-(trifluoromethyl)quinoline-3-carboxamide

Systemtic Name: N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-4-(trifluoromethyl)quinoline-3-carboxamide Openeye Name: N-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-4-(trifluoromethyl)quinoline-3-carboxamide CAS Name: N-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-4-(trifluoromethyl)-3-quinolinecarboxamide IUPAC Name: N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-4-(trifluoromethyl)quinoline-3-carboxamide Traditional Name: N-(4-chloro-3-piperidinosulfonyl-phenyl)-4-(trifluoromethyl)quinoline-3-carboxamide Formula: C22H19ClF3N3O3S MolecularWeight: 497.91777

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=C(C4=CC=CC=C4N=C3)C(F)(F)F)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=C(C4=CC=CC=C4N=C3)C(F)(F)F)Cl

InChI

InChI=1S/C22H19ClF3N3O3S/c23-17-9-8-14(12-19(17)33(31,32)29-10-4-1-5-11-29)28-21(30)16-13-27-18-7-3-2-6-15(18)20(16)22(24,25)26/h2-3,6-9,12-13H,1,4-5,10-11H2,(H,28,30)