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

Systemtic Name: 4-(5-chloranyl-2-oxidanyl-phenyl)-3-(4-methoxy-2-oxidanylidene-butyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Openeye Name: 4-(5-chloro-2-hydroxy-phenyl)-3-(4-methoxy-2-oxo-butyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one CAS Name: 4-(5-chloro-2-hydroxyphenyl)-3-[(4-methoxy-2-oxobutyl)thio]-6-(trifluoromethyl)-1H-quinolin-2-one IUPAC Name: 4-(5-chloro-2-hydroxyphenyl)-3-(4-methoxy-2-oxobutyl)sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Traditional Name: 4-(5-chloro-2-hydroxy-phenyl)-3-[(2-keto-4-methoxy-butyl)thio]-6-(trifluoromethyl)carbostyril Formula: C21H17ClF3NO4S MolecularWeight: 471.87719

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(=O)CSC1=C(C2=C(C=CC(=C2)C(F)(F)F)NC1=O)C3=C(C=CC(=C3)Cl)O

Isomeric SMILES

COCCC(=O)CSC1=C(C2=C(C=CC(=C2)C(F)(F)F)NC1=O)C3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C21H17ClF3NO4S/c1-30-7-6-13(27)10-31-19-18(15-9-12(22)3-5-17(15)28)14-8-11(21(23,24)25)2-4-16(14)26-20(19)29/h2-5,8-9,28H,6-7,10H2,1H3,(H,26,29)