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

Systemtic Name: 4-(5-chloranyl-2-oxidanyl-phenyl)-3-(2-oxidanylidene-5-thiomorpholin-4-yl-pentyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Openeye Name: 4-(5-chloro-2-hydroxy-phenyl)-3-(2-oxo-5-thiomorpholino-pentyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one CAS Name: 4-(5-chloro-2-hydroxyphenyl)-3-[(2-oxo-5-thiomorpholin-4-ylpentyl)thio]-6-(trifluoromethyl)-1H-quinolin-2-one IUPAC Name: 4-(5-chloro-2-hydroxyphenyl)-3-(2-oxo-5-thiomorpholin-4-ylpentyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Traditional Name: 4-(5-chloro-2-hydroxy-phenyl)-3-[(2-keto-5-thiomorpholino-pentyl)thio]-6-(trifluoromethyl)carbostyril Formula: C25H24ClF3N2O3S2 MolecularWeight: 557.04787

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1CCCC(=O)CSC2=C(C3=C(C=CC(=C3)C(F)(F)F)NC2=O)C4=C(C=CC(=C4)Cl)O

Isomeric SMILES

C1CSCCN1CCCC(=O)CSC2=C(C3=C(C=CC(=C3)C(F)(F)F)NC2=O)C4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C25H24ClF3N2O3S2/c26-16-4-6-21(33)19(13-16)22-18-12-15(25(27,28)29)3-5-20(18)30-24(34)23(22)36-14-17(32)2-1-7-31-8-10-35-11-9-31/h3-6,12-13,33H,1-2,7-11,14H2,(H,30,34)