N-[[3-fluoranyl-4-[6-methoxy-7-(2-oxidanyl-3-piperidin-1-yl-propoxy)quinolin-4-yl]oxy-phenyl]carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[[3-fluoranyl-4-[6-methoxy-7-(2-oxidanyl-3-piperidin-1-yl-propoxy)quinolin-4-yl]oxy-phenyl]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[3-fluoro-4-[[7-[2-hydroxy-3-(1-piperidyl)propoxy]-6-methoxy-4-quinolyl]oxy]phenyl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[3-fluoro-4-[[7-[2-hydroxy-3-(1-piperidinyl)propoxy]-6-methoxy-4-quinolinyl]oxy]anilino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[3-fluoro-4-[7-(2-hydroxy-3-piperidin-1-ylpropoxy)-6-methoxyquinolin-4-yl]oxyphenyl]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[3-fluoro-4-[[7-(2-hydroxy-3-piperidino-propoxy)-6-methoxy-4-quinolyl]oxy]phenyl]thiocarbamoyl]-2-phenyl-acetamide Formula: C33H35FN4O5S MolecularWeight: 618.718203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OCC(CN3CCCCC3)O)OC4=C(C=C(C=C4)NC(=S)NC(=O)CC5=CC=CC=C5)F

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OCC(CN3CCCCC3)O)OC4=C(C=C(C=C4)NC(=S)NC(=O)CC5=CC=CC=C5)F

InChI

InChI=1S/C33H35FN4O5S/c1-41-30-18-25-27(19-31(30)42-21-24(39)20-38-14-6-3-7-15-38)35-13-12-28(25)43-29-11-10-23(17-26(29)34)36-33(44)37-32(40)16-22-8-4-2-5-9-22/h2,4-5,8-13,17-19,24,39H,3,6-7,14-16,20-21H2,1H3,(H2,36,37,40,44)