OSDDMalaria:GSK Arylpyrrole Series:desired compounds: Difference between revisions

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=== InChi list: ===
=== InChi list: ===


Left to right, sequentially in the same order as the image.
Left to right, sequentially in the same order as the image:
 
InChI=1S/C15H18FN3O/c1-10-7-12(8-18-9-15(17)20)11(2)19(10)14-5-3-13(16)4-6-14/h3-7,18H,8-9H2,1-2H3,(H2,17,20)
InChI=1S/C16H20FN3O/c1-11-8-13(9-19(3)10-16(18)21)12(2)20(11)15-6-4-14(17)5-7-15/h4-8H,9-10H2,1-3H3,(H2,18,21)
InChI=1S/C16H18FN3O2/c1-10-8-14(16(22)19(3)9-15(18)21)11(2)20(10)13-6-4-12(17)5-7-13/h4-8H,9H2,1-3H3,(H2,18,21)
InChI=1S/C15H17FN2O2/c1-10-7-12(8-20-9-15(17)19)11(2)18(10)14-5-3-13(16)4-6-14/h3-7H,8-9H2,1-2H3,(H2,17,19)
InChI=1S/C13H11FN2O3/c14-10-1-3-11(4-2-10)16-6-5-9(7-16)13(18)19-8-12(15)17/h1-7H,8H2,(H2,15,17)
InChI=1S/C15H15FN2O3/c1-9-7-18(12-5-3-11(16)4-6-12)10(2)14(9)15(20)21-8-13(17)19/h3-7H,8H2,1-2H3,(H2,17,19)
InChI=1S/C14H13FN2O3/c1-9-6-10(14(19)20-8-13(16)18)7-17(9)12-4-2-11(15)3-5-12/h2-7H,8H2,1H3,(H2,16,18)
InChI=1S/C14H13FN2O3/c1-9-12(14(19)20-8-13(16)18)6-7-17(9)11-4-2-10(15)3-5-11/h2-7H,8H2,1H3,(H2,16,18)
InChI=1S/C13H12FN3O3/c1-8-11(13(19)20-7-12(15)18)6-16-17(8)10-4-2-9(14)3-5-10/h2-6H,7H2,1H3,(H2,15,18)
InChI=1S/C14H11FN4O2/c1-8-11(14-18-12(7-21-14)13(16)20)6-17-19(8)10-4-2-9(15)3-5-10/h2-7H,1H3,(H2,16,20)
InChI=1S/C16H14FN3O2/c1-9-7-13(16-19-14(8-22-16)15(18)21)10(2)20(9)12-5-3-11(17)4-6-12/h3-8H,1-2H3,(H2,18,21)
InChI=1S/C14H11FN4O2/c1-8-11(14-18-12(7-21-14)13(16)20)6-17-19(8)10-4-2-9(15)3-5-10/h2-7H,1H3,(H2,16,20)
 
The above in Chemdraw SMILES:
 
FC1=CC=C(N2C(C)=CC(CNCC(N)=O)=C2C)C=C1
FC1=CC=C(N2C(C)=CC(CN(C)CC(N)=O)=C2C)C=C1
FC1=CC=C(N2C(C)=CC(C(N(C)CC(N)=O)=O)=C2C)C=C1
FC1=CC=C(N2C(C)=CC(COCC(N)=O)=C2C)C=C1
FC1=CC=C(N2C=CC(C(OCC(N)=O)=O)=C2)C=C1
FC1=CC=C(N2C=C(C)C(C(OCC(N)=O)=O)=C2C)C=C1
FC1=CC=C(N2C(C)=CC(C(OCC(N)=O)=O)=C2)C=C1
FC1=CC=C(N2C=CC(C(OCC(N)=O)=O)=C2C)C=C1
FC1=CC=C(N2N=CC(C(OCC(N)=O)=O)=C2C)C=C1
FC1=CC=C(N2N=CC(C3=NC(C(N)=O)=CO3)=C2C)C=C1
FC1=CC=C(N2C(C)=CC(C3=NC(C(N)=O)=CO3)=C2C)C=C1
FC1=CC=C(N2N=CC(C3=NC(C(N)=O)=CO3)=C2C)C=C1

Revision as of 17:08, 4 April 2012

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Desired Analogues

This is a list of compounds we are currently targeting or would like to have access to. If you happen to have some of these compounds, or their close analogues, in your labs or would like to make them then please get in touch.

Image

InChi list:

Left to right, sequentially in the same order as the image:

InChI=1S/C15H18FN3O/c1-10-7-12(8-18-9-15(17)20)11(2)19(10)14-5-3-13(16)4-6-14/h3-7,18H,8-9H2,1-2H3,(H2,17,20) InChI=1S/C16H20FN3O/c1-11-8-13(9-19(3)10-16(18)21)12(2)20(11)15-6-4-14(17)5-7-15/h4-8H,9-10H2,1-3H3,(H2,18,21) InChI=1S/C16H18FN3O2/c1-10-8-14(16(22)19(3)9-15(18)21)11(2)20(10)13-6-4-12(17)5-7-13/h4-8H,9H2,1-3H3,(H2,18,21) InChI=1S/C15H17FN2O2/c1-10-7-12(8-20-9-15(17)19)11(2)18(10)14-5-3-13(16)4-6-14/h3-7H,8-9H2,1-2H3,(H2,17,19) InChI=1S/C13H11FN2O3/c14-10-1-3-11(4-2-10)16-6-5-9(7-16)13(18)19-8-12(15)17/h1-7H,8H2,(H2,15,17) InChI=1S/C15H15FN2O3/c1-9-7-18(12-5-3-11(16)4-6-12)10(2)14(9)15(20)21-8-13(17)19/h3-7H,8H2,1-2H3,(H2,17,19) InChI=1S/C14H13FN2O3/c1-9-6-10(14(19)20-8-13(16)18)7-17(9)12-4-2-11(15)3-5-12/h2-7H,8H2,1H3,(H2,16,18) InChI=1S/C14H13FN2O3/c1-9-12(14(19)20-8-13(16)18)6-7-17(9)11-4-2-10(15)3-5-11/h2-7H,8H2,1H3,(H2,16,18) InChI=1S/C13H12FN3O3/c1-8-11(13(19)20-7-12(15)18)6-16-17(8)10-4-2-9(14)3-5-10/h2-6H,7H2,1H3,(H2,15,18) InChI=1S/C14H11FN4O2/c1-8-11(14-18-12(7-21-14)13(16)20)6-17-19(8)10-4-2-9(15)3-5-10/h2-7H,1H3,(H2,16,20) InChI=1S/C16H14FN3O2/c1-9-7-13(16-19-14(8-22-16)15(18)21)10(2)20(9)12-5-3-11(17)4-6-12/h3-8H,1-2H3,(H2,18,21) InChI=1S/C14H11FN4O2/c1-8-11(14-18-12(7-21-14)13(16)20)6-17-19(8)10-4-2-9(15)3-5-10/h2-7H,1H3,(H2,16,20)

The above in Chemdraw SMILES:

FC1=CC=C(N2C(C)=CC(CNCC(N)=O)=C2C)C=C1 FC1=CC=C(N2C(C)=CC(CN(C)CC(N)=O)=C2C)C=C1 FC1=CC=C(N2C(C)=CC(C(N(C)CC(N)=O)=O)=C2C)C=C1 FC1=CC=C(N2C(C)=CC(COCC(N)=O)=C2C)C=C1 FC1=CC=C(N2C=CC(C(OCC(N)=O)=O)=C2)C=C1 FC1=CC=C(N2C=C(C)C(C(OCC(N)=O)=O)=C2C)C=C1 FC1=CC=C(N2C(C)=CC(C(OCC(N)=O)=O)=C2)C=C1 FC1=CC=C(N2C=CC(C(OCC(N)=O)=O)=C2C)C=C1 FC1=CC=C(N2N=CC(C(OCC(N)=O)=O)=C2C)C=C1 FC1=CC=C(N2N=CC(C3=NC(C(N)=O)=CO3)=C2C)C=C1 FC1=CC=C(N2C(C)=CC(C3=NC(C(N)=O)=CO3)=C2C)C=C1 FC1=CC=C(N2N=CC(C3=NC(C(N)=O)=CO3)=C2C)C=C1

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