N-[2-(cyclohexen-1-yl)ethyl]-N-[[7-methylsulfanyl-2-(4-oxidanylpiperidin-1-yl)quinolin-3-yl]methyl]cyclobutanecarboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-N-[[7-methylsulfanyl-2-(4-oxidanylpiperidin-1-yl)quinolin-3-yl]methyl]cyclobutanecarboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-N-[[2-(4-hydroxy-1-piperidyl)-7-methylsulfanyl-3-quinolyl]methyl]cyclobutanecarboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-N-[[2-(4-hydroxy-1-piperidinyl)-7-(methylthio)-3-quinolinyl]methyl]cyclobutanecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-N-[[2-(4-hydroxypiperidin-1-yl)-7-methylsulfanylquinolin-3-yl]methyl]cyclobutanecarboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-N-[[2-(4-hydroxypiperidino)-7-(methylthio)-3-quinolyl]methyl]cyclobutanecarboxamide Formula: C29H39N3O2S MolecularWeight: 493.70386

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)CN(CCC3=CCCCC3)C(=O)C4CCC4)N5CCC(CC5)O

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)CN(CCC3=CCCCC3)C(=O)C4CCC4)N5CCC(CC5)O

InChI

InChI=1S/C29H39N3O2S/c1-35-26-11-10-23-18-24(28(30-27(23)19-26)31-16-13-25(33)14-17-31)20-32(29(34)22-8-5-9-22)15-12-21-6-3-2-4-7-21/h6,10-11,18-19,22,25,33H,2-5,7-9,12-17,20H2,1H3