4-(5-chloranyl-2-oxidanyl-phenyl)-3-(2-oxidanyl-5-piperidin-1-yl-pentyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one

Systemtic Name: 4-(5-chloranyl-2-oxidanyl-phenyl)-3-(2-oxidanyl-5-piperidin-1-yl-pentyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Openeye Name: 4-(5-chloro-2-hydroxy-phenyl)-3-[2-hydroxy-5-(1-piperidyl)pentyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one CAS Name: 4-(5-chloro-2-hydroxyphenyl)-3-[[2-hydroxy-5-(1-piperidinyl)pentyl]thio]-6-(trifluoromethyl)-1H-quinolin-2-one IUPAC Name: 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxy-5-piperidin-1-ylpentyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Traditional Name: 4-(5-chloro-2-hydroxy-phenyl)-3-[(2-hydroxy-5-piperidino-pentyl)thio]-6-(trifluoromethyl)carbostyril Formula: C26H28ClF3N2O3S MolecularWeight: 541.02533

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCC(CSC2=C(C3=C(C=CC(=C3)C(F)(F)F)NC2=O)C4=C(C=CC(=C4)Cl)O)O

Isomeric SMILES

C1CCN(CC1)CCCC(CSC2=C(C3=C(C=CC(=C3)C(F)(F)F)NC2=O)C4=C(C=CC(=C4)Cl)O)O

InChI

InChI=1S/C26H28ClF3N2O3S/c27-17-7-9-22(34)20(14-17)23-19-13-16(26(28,29)30)6-8-21(19)31-25(35)24(23)36-15-18(33)5-4-12-32-10-2-1-3-11-32/h6-9,13-14,18,33-34H,1-5,10-12,15H2,(H,31,35)