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

Systemtic Name: 4-(5-chloranyl-2-oxidanyl-phenyl)-3-(2-oxidanyl-4-piperidin-1-yl-butyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Openeye Name: 4-(5-chloro-2-hydroxy-phenyl)-3-[2-hydroxy-4-(1-piperidyl)butyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one CAS Name: 4-(5-chloro-2-hydroxyphenyl)-3-[[2-hydroxy-4-(1-piperidinyl)butyl]thio]-6-(trifluoromethyl)-1H-quinolin-2-one IUPAC Name: 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxy-4-piperidin-1-ylbutyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Traditional Name: 4-(5-chloro-2-hydroxy-phenyl)-3-[(2-hydroxy-4-piperidino-butyl)thio]-6-(trifluoromethyl)carbostyril Formula: C25H26ClF3N2O3S MolecularWeight: 526.99875

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C25H26ClF3N2O3S/c26-16-5-7-21(33)19(13-16)22-18-12-15(25(27,28)29)4-6-20(18)30-24(34)23(22)35-14-17(32)8-11-31-9-2-1-3-10-31/h4-7,12-13,17,32-33H,1-3,8-11,14H2,(H,30,34)