3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 3-[oxo-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-1H-quinolin-2-one IUPAC Name: 3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]carbostyril Formula: C21H18F3N3O4S MolecularWeight: 465.44553

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3NC2=O)S(=O)(=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3NC2=O)S(=O)(=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O4S/c22-21(23,24)15-5-7-16(8-6-15)32(30,31)27-11-9-26(10-12-27)20(29)17-13-14-3-1-2-4-18(14)25-19(17)28/h1-8,13H,9-12H2,(H,25,28)