2-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-N-quinolin-5-yl-ethanamide

Systemtic Name: 2-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-N-quinolin-5-yl-ethanamide Openeye Name: 2-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]-N-(5-quinolyl)acetamide CAS Name: 2-[4-(2,6-difluorophenyl)sulfonyl-1-piperazinyl]-N-(5-quinolinyl)acetamide IUPAC Name: 2-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]-N-quinolin-5-ylacetamide Traditional Name: 2-[4-(2,6-difluorophenyl)sulfonylpiperazino]-N-(5-quinolyl)acetamide Formula: C21H20F2N4O3S MolecularWeight: 446.470306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC3=C2C=CC=N3)S(=O)(=O)C4=C(C=CC=C4F)F

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC3=C2C=CC=N3)S(=O)(=O)C4=C(C=CC=C4F)F

InChI

InChI=1S/C21H20F2N4O3S/c22-16-5-1-6-17(23)21(16)31(29,30)27-12-10-26(11-13-27)14-20(28)25-19-8-2-7-18-15(19)4-3-9-24-18/h1-9H,10-14H2,(H,25,28)