4-[4-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 4-[4-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 4-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 4-[[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 4-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 4-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]carbostyril Formula: C21H17ClF3N3O4S MolecularWeight: 499.89059

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=O)NC3=CC=CC=C32)S(=O)(=O)C4=C(C=CC(=C4)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=O)NC3=CC=CC=C32)S(=O)(=O)C4=C(C=CC(=C4)C(F)(F)F)Cl

InChI

InChI=1S/C21H17ClF3N3O4S/c22-16-6-5-13(21(23,24)25)11-18(16)33(31,32)28-9-7-27(8-10-28)20(30)15-12-19(29)26-17-4-2-1-3-14(15)17/h1-6,11-12H,7-10H2,(H,26,29)