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

Systemtic Name: 4-(5-chloranyl-2-oxidanyl-phenyl)-3-[2-oxidanyl-5-(3-oxidanylpyrrolidin-1-yl)pentyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Openeye Name: 4-(5-chloro-2-hydroxy-phenyl)-3-[2-hydroxy-5-(3-hydroxypyrrolidin-1-yl)pentyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one CAS Name: 4-(5-chloro-2-hydroxyphenyl)-3-[[2-hydroxy-5-(3-hydroxy-1-pyrrolidinyl)pentyl]thio]-6-(trifluoromethyl)-1H-quinolin-2-one IUPAC Name: 4-(5-chloro-2-hydroxyphenyl)-3-[2-hydroxy-5-(3-hydroxypyrrolidin-1-yl)pentyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Traditional Name: 4-(5-chloro-2-hydroxy-phenyl)-3-[[2-hydroxy-5-(3-hydroxypyrrolidino)pentyl]thio]-6-(trifluoromethyl)carbostyril Formula: C25H26ClF3N2O4S MolecularWeight: 542.99815

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)CCCC(CSC2=C(C3=C(C=CC(=C3)C(F)(F)F)NC2=O)C4=C(C=CC(=C4)Cl)O)O

Isomeric SMILES

C1CN(CC1O)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/C25H26ClF3N2O4S/c26-15-4-6-21(34)19(11-15)22-18-10-14(25(27,28)29)3-5-20(18)30-24(35)23(22)36-13-17(33)2-1-8-31-9-7-16(32)12-31/h3-6,10-11,16-17,32-34H,1-2,7-9,12-13H2,(H,30,35)