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

Systemtic Name: N-[[7-fluoranyl-2-(4-oxidanylpiperidin-1-yl)quinolin-3-yl]methyl]-N-[(4-methoxyphenyl)methyl]-4-pyrazol-1-yl-benzamide Openeye Name: N-[[7-fluoro-2-(4-hydroxy-1-piperidyl)-3-quinolyl]methyl]-N-[(4-methoxyphenyl)methyl]-4-pyrazol-1-yl-benzamide CAS Name: N-[[7-fluoro-2-(4-hydroxy-1-piperidinyl)-3-quinolinyl]methyl]-N-[(4-methoxyphenyl)methyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-[[7-fluoro-2-(4-hydroxypiperidin-1-yl)quinolin-3-yl]methyl]-N-[(4-methoxyphenyl)methyl]-4-pyrazol-1-ylbenzamide Traditional Name: N-[[7-fluoro-2-(4-hydroxypiperidino)-3-quinolyl]methyl]-N-p-anisyl-4-pyrazol-1-yl-benzamide Formula: C33H32FN5O3 MolecularWeight: 565.637283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)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

COC1=CC=C(C=C1)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/C33H32FN5O3/c1-42-30-11-3-23(4-12-30)21-38(33(41)24-6-9-28(10-7-24)39-16-2-15-35-39)22-26-19-25-5-8-27(34)20-31(25)36-32(26)37-17-13-29(40)14-18-37/h2-12,15-16,19-20,29,40H,13-14,17-18,21-22H2,1H3