{[5-(3-{[1-(benzylsulfonyl)piperidin-4-yl]amino}phenyl)-4-bromo-2-(2H-tetrazol-5-yl)-3-thienyl]oxy}acetic acid (Q27456932)

CHEMBL241070 (English)

19 October 2016

chemical formula

C₂₅H₂₅BrN₆O₅S₂

1 reference

CHEMBL241070 (English)

19 October 2016

canonical SMILES

C1CN(CCC1NC2=CC=CC(=C2)C3=C(C(=C(S3)C4=NNN=N4)OCC(=O)O)Br)S(=O)(=O)CC5=CC=CC=C5

1 reference

CHEMBL241070 (English)

InChI=1S/C25H25BrN6O5S2/c26-21-22(37-14-20(33)34)24(25-28-30-31-29-25)38-23(21)17-7-4-8-19(13-17)27-18-9-11-32(12-10-18)39(35,36)15-16-5-2-1-3-6-16/h1-8,13,18,27H,9-12,14-15H2,(H,33,34)(H,28,29,30,31)

19 October 2016

Identifiers

InChI

1 reference

CHEMBL241070 (English)

XUNHAAXAXQCMHA-UHFFFAOYSA-N

19 October 2016

InChIKey

1 reference

CHEMBL241070 (English)

19 October 2016

1 reference

{[5-(3-{[1-(Benzylsulfonyl)-4-piperidinyl]amino}phenyl)-4-bromo-2-(2H-tetrazol-5-yl)-3-thienyl]oxy}acetic acid (English)

19 October 2016

2 references

CHEMBL241070 (English)

matched by identifier from

19 October 2016

InChIKey

XUNHAAXAXQCMHA-UHFFFAOYSA-N

1 reference

CHEMBL241070 (English)

19 October 2016

1 reference

0 references

1 reference

2NT7 (English)