N-[(3S)-1-{2-fluoro-4-[(5S)-5-{[(propan-2-ylsulfonyl)amino]methyl}-4,5-dihydro-1,2-oxazol-3-yl]phenyl}pyrrolidin-3-yl]acetamide (Q27452587)

CHEMBL3109791 (English)

19 October 2016

chemical formula

C₁₉H₂₇FN₄O₄S

1 reference

CHEMBL3109791 (English)

19 October 2016

canonical SMILES

CC(C)S(=O)(=O)NCC1CC(=NO1)C2=CC(=C(C=C2)N3CCC(C3)NC(=O)C)F

1 reference

CHEMBL3109791 (English)

19 October 2016

isomeric SMILES

CC(C)S(=O)(=O)NC[C@@H]1CC(=NO1)C2=CC(=C(C=C2)N3CC[C@@H](C3)NC(=O)C)F

1 reference

CHEMBL3109791 (English)

InChI=1S/C19H27FN4O4S/c1-12(2)29(26,27)21-10-16-9-18(23-28-16)14-4-5-19(17(20)8-14)24-7-6-15(11-24)22-13(3)25/h4-5,8,12,15-16,21H,6-7,9-11H2,1-3H3,(H,22,25)/t15-,16-/m0/s1

19 October 2016

Identifiers

InChI

1 reference

CHEMBL3109791 (English)

XCANXEILGPMNGT-HOTGVXAUSA-N

19 October 2016

InChIKey

1 reference

CHEMBL3109791 (English)

19 October 2016

1 reference

N-[(3S)-1-{2-Fluoro-4-[(5S)-5-{[(isopropylsulfonyl)amino]methyl}-4,5-dihydro-1,2-oxazol-3-yl]phenyl}-3-pyrrolidinyl]acetamide (English)

19 October 2016

1 reference

CHEMBL3109791 (English)

19 October 2016

1 reference

CHEMBL3109791 (English)

19 October 2016

1 reference

0 references

1 reference

4LZ8 (English)