N-[[7-fluoranyl-2-(4-oxidanylpiperidin-1-yl)quinolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)-4-pyrazol-1-yl-benzamide

Systemtic Name: N-[[7-fluoranyl-2-(4-oxidanylpiperidin-1-yl)quinolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)-4-pyrazol-1-yl-benzamide Openeye Name: N-[[7-fluoro-2-(4-hydroxy-1-piperidyl)-3-quinolyl]methyl]-4-pyrazol-1-yl-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: N-[[7-fluoro-2-(4-hydroxy-1-piperidinyl)-3-quinolinyl]methyl]-N-(2-oxolanylmethyl)-4-(1-pyrazolyl)benzamide IUPAC Name: N-[[7-fluoro-2-(4-hydroxypiperidin-1-yl)quinolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)-4-pyrazol-1-ylbenzamide Traditional Name: N-[[7-fluoro-2-(4-hydroxypiperidino)-3-quinolyl]methyl]-4-pyrazol-1-yl-N-(tetrahydrofurfuryl)benzamide Formula: C30H32FN5O3 MolecularWeight: 529.605183

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=C(N=C3C=C(C=CC3=C2)F)N4CCC(CC4)O)C(=O)C5=CC=C(C=C5)N6C=CC=N6

Isomeric SMILES

C1CC(OC1)CN(CC2=C(N=C3C=C(C=CC3=C2)F)N4CCC(CC4)O)C(=O)C5=CC=C(C=C5)N6C=CC=N6

InChI

InChI=1S/C30H32FN5O3/c31-24-7-4-22-17-23(29(33-28(22)18-24)34-14-10-26(37)11-15-34)19-35(20-27-3-1-16-39-27)30(38)21-5-8-25(9-6-21)36-13-2-12-32-36/h2,4-9,12-13,17-18,26-27,37H,1,3,10-11,14-16,19-20H2