5-(3-{[1-(benzylsulfonyl)piperidin-4-yl]amino}phenyl)-4-bromo-3-(carboxymethoxy)thiophene-2-carboxylic acid (Q27455409)

CHEMBL541214 (English)

19 October 2016

chemical formula

C₂₅H₂₅BrN₂O₇S₂

1 reference

CHEMBL541214 (English)

19 October 2016

canonical SMILES

C1CN(CCC1NC2=CC=CC(=C2)C3=C(C(=C(S3)C(=O)O)OCC(=O)O)Br)S(=O)(=O)CC4=CC=CC=C4

1 reference

CHEMBL541214 (English)

InChI=1S/C25H25BrN2O7S2/c26-21-22(35-14-20(29)30)24(25(31)32)36-23(21)17-7-4-8-19(13-17)27-18-9-11-28(12-10-18)37(33,34)15-16-5-2-1-3-6-16/h1-8,13,18,27H,9-12,14-15H2,(H,29,30)(H,31,32)

19 October 2016

Identifiers

InChI

1 reference

CHEMBL541214 (English)

FEPAAIQAIYOLJA-UHFFFAOYSA-N

19 October 2016

InChIKey

1 reference

CHEMBL541214 (English)

19 October 2016

1 reference

5-(3-{[1-(Benzylsulfonyl)-4-piperidinyl]amino}phenyl)-4-bromo-3-(carboxymethoxy)-2-thiophenecarboxylic acid (English)

19 October 2016

1 reference

CHEMBL541214 (English)

19 October 2016

1 reference

CHEMBL541214 (English)

19 October 2016

1 reference

0 references

1 reference

2QBP (English)