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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=C(C(=O)NC3=C2C=C(C=C3)C(F)(F)F)SCC(CN4CCCCC4)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=C(C(=O)NC3=C2C=C(C=C3)C(F)(F)F)SCC(CN4CCCCC4)O

InChI

InChI=1S/C25H26ClF3N2O3S/c1-34-21-8-6-16(26)12-19(21)22-18-11-15(25(27,28)29)5-7-20(18)30-24(33)23(22)35-14-17(32)13-31-9-3-2-4-10-31/h5-8,11-12,17,32H,2-4,9-10,13-14H2,1H3,(H,30,33)