6-({[(3R,5S)-5-{[(6-amino-4-methylpyridin-2-yl)methoxy]methyl}pyrrolidin-3-yl]oxy}methyl)-4-methylpyridin-2-amine (Q27464739)

CHEMBL3109186 (English)

5R)-5-(((6-amino-4-methylpyridin-2-yl)methoxy)methyl)pyrrolidin-3-yl)oxy)methyl)-4-methylpyridin-2-amine6-((((3S

19 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₉H₂₇N₅O₂

1 reference

CHEMBL3109186 (English)

19 October 2016

canonical SMILES

CC1=CC(=NC(=C1)N)COCC2CC(CN2)OCC3=NC(=CC(=C3)C)N

1 reference

CHEMBL3109186 (English)

19 October 2016

isomeric SMILES

CC1=CC(=NC(=C1)N)COC[C@@H]2C[C@H](CN2)OCC3=NC(=CC(=C3)C)N

1 reference

CHEMBL3109186 (English)

InChI=1S/C19H27N5O2/c1-12-3-15(23-18(20)5-12)10-25-9-14-7-17(8-22-14)26-11-16-4-13(2)6-19(21)24-16/h3-6,14,17,22H,7-11H2,1-2H3,(H2,20,23)(H2,21,24)/t14-,17+/m0/s1

19 October 2016

Identifiers

InChI

1 reference

CHEMBL3109186 (English)

NUKSCYDKRQJOFO-WMLDXEAASA-N

19 October 2016

InChIKey

1 reference

CHEMBL3109186 (English)

19 October 2016

1 reference

6-({[(3R,5S)-5-{[(6-Amino-4-methyl-2-pyridinyl)methoxy]methyl}-3-pyrrolidinyl]oxy}methyl)-4-methyl-2-pyridinamine (English)

19 October 2016

1 reference

CHEMBL3109186 (English)

19 October 2016

1 reference

CHEMBL3109186 (English)

19 October 2016

1 reference

0 references

1 reference

4LWB (English)

19 October 2016

1 reference

4LUX (English)

19 October 2016

1 reference

4LUW (English)