4-(5-chloranyl-2-oxidanyl-phenyl)-3-[5-[cyclohexyl(prop-2-enyl)amino]-2-oxidanyl-pentyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one

Systemtic Name: 4-(5-chloranyl-2-oxidanyl-phenyl)-3-[5-[cyclohexyl(prop-2-enyl)amino]-2-oxidanyl-pentyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Openeye Name: 3-[5-[allyl(cyclohexyl)amino]-2-hydroxy-pentyl]sulfanyl-4-(5-chloro-2-hydroxy-phenyl)-6-(trifluoromethyl)-1H-quinolin-2-one CAS Name: 4-(5-chloro-2-hydroxyphenyl)-3-[[5-[cyclohexyl(prop-2-enyl)amino]-2-hydroxypentyl]thio]-6-(trifluoromethyl)-1H-quinolin-2-one IUPAC Name: 4-(5-chloro-2-hydroxyphenyl)-3-[5-[cyclohexyl(prop-2-enyl)amino]-2-hydroxypentyl]sulfanyl-6-(trifluoromethyl)-1H-quinolin-2-one Traditional Name: 3-[[5-[allyl(cyclohexyl)amino]-2-hydroxy-pentyl]thio]-4-(5-chloro-2-hydroxy-phenyl)-6-(trifluoromethyl)carbostyril Formula: C30H34ClF3N2O3S MolecularWeight: 595.11577

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CCCC(CSC1=C(C2=C(C=CC(=C2)C(F)(F)F)NC1=O)C3=C(C=CC(=C3)Cl)O)O)C4CCCCC4

Isomeric SMILES

C=CCN(CCCC(CSC1=C(C2=C(C=CC(=C2)C(F)(F)F)NC1=O)C3=C(C=CC(=C3)Cl)O)O)C4CCCCC4

InChI

InChI=1S/C30H34ClF3N2O3S/c1-2-14-36(21-7-4-3-5-8-21)15-6-9-22(37)18-40-28-27(24-17-20(31)11-13-26(24)38)23-16-19(30(32,33)34)10-12-25(23)35-29(28)39/h2,10-13,16-17,21-22,37-38H,1,3-9,14-15,18H2,(H,35,39)