N-(furan-2-ylmethyl)-4-methoxy-N-[[7-methylsulfanyl-2-(4-oxidanylpiperidin-1-yl)quinolin-3-yl]methyl]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-4-methoxy-N-[[7-methylsulfanyl-2-(4-oxidanylpiperidin-1-yl)quinolin-3-yl]methyl]benzamide Openeye Name: N-(2-furylmethyl)-N-[[2-(4-hydroxy-1-piperidyl)-7-methylsulfanyl-3-quinolyl]methyl]-4-methoxy-benzamide CAS Name: N-(2-furanylmethyl)-N-[[2-(4-hydroxy-1-piperidinyl)-7-(methylthio)-3-quinolinyl]methyl]-4-methoxybenzamide IUPAC Name: N-(furan-2-ylmethyl)-N-[[2-(4-hydroxypiperidin-1-yl)-7-methylsulfanylquinolin-3-yl]methyl]-4-methoxybenzamide Traditional Name: N-(2-furfuryl)-N-[[2-(4-hydroxypiperidino)-7-(methylthio)-3-quinolyl]methyl]-4-methoxy-benzamide Formula: C29H31N3O4S MolecularWeight: 517.63914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CC2=CC=CO2)CC3=C(N=C4C=C(C=CC4=C3)SC)N5CCC(CC5)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CC2=CC=CO2)CC3=C(N=C4C=C(C=CC4=C3)SC)N5CCC(CC5)O

InChI

InChI=1S/C29H31N3O4S/c1-35-24-8-5-20(6-9-24)29(34)32(19-25-4-3-15-36-25)18-22-16-21-7-10-26(37-2)17-27(21)30-28(22)31-13-11-23(33)12-14-31/h3-10,15-17,23,33H,11-14,18-19H2,1-2H3