2-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-N-quinolin-5-yl-ethanamide

Systemtic Name: 2-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-N-quinolin-5-yl-ethanamide Openeye Name: 2-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-N-(5-quinolyl)acetamide CAS Name: 2-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-N-(5-quinolinyl)acetamide IUPAC Name: 2-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-N-quinolin-5-ylacetamide Traditional Name: 2-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-N-(5-quinolyl)acetamide Formula: C21H20ClFN4O3S MolecularWeight: 462.924903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClFN4O3S/c22-17-13-15(6-7-18(17)23)31(29,30)27-11-9-26(10-12-27)14-21(28)25-20-5-1-4-19-16(20)3-2-8-24-19/h1-8,13H,9-12,14H2,(H,25,28)