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

Systemtic Name: 4-(5-chloranyl-2-methoxy-phenyl)-3-[3-(4-methylpiperidin-1-yl)-2-oxidanyl-propyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Openeye Name: 4-(5-chloro-2-methoxy-phenyl)-3-[2-hydroxy-3-(4-methyl-1-piperidyl)propyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one CAS Name: 4-(5-chloro-2-methoxyphenyl)-3-[[2-hydroxy-3-(4-methyl-1-piperidinyl)propyl]thio]-6-(trifluoromethyl)-1H-quinolin-2-one IUPAC Name: 4-(5-chloro-2-methoxyphenyl)-3-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Traditional Name: 4-(5-chloro-2-methoxy-phenyl)-3-[[2-hydroxy-3-(4-methylpiperidino)propyl]thio]-6-(trifluoromethyl)carbostyril Formula: C26H28ClF3N2O3S MolecularWeight: 541.02533

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC(CSC2=C(C3=C(C=CC(=C3)C(F)(F)F)NC2=O)C4=C(C=CC(=C4)Cl)OC)O

Isomeric SMILES

CC1CCN(CC1)CC(CSC2=C(C3=C(C=CC(=C3)C(F)(F)F)NC2=O)C4=C(C=CC(=C4)Cl)OC)O

InChI

InChI=1S/C26H28ClF3N2O3S/c1-15-7-9-32(10-8-15)13-18(33)14-36-24-23(20-12-17(27)4-6-22(20)35-2)19-11-16(26(28,29)30)3-5-21(19)31-25(24)34/h3-6,11-12,15,18,33H,7-10,13-14H2,1-2H3,(H,31,34)