(4-{2-[({3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxopropyl}carbamoyl)amino]ethyl}benzyl)propanedioic acid (Q27456857)

LDHA Inhibitor, 29 (English)

19 October 2016

chemical formula

C₂₄H₂₆N₄O₆S

1 reference

LDHA Inhibitor, 29 (English)

19 October 2016

canonical SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CCNC(=O)NCCC3=CC=C(C=C3)CC(C(=O)O)C(=O)O

1 reference

LDHA Inhibitor, 29 (English)

InChI=1S/C24H26N4O6S/c1-14-27-19-7-6-17(13-20(19)35-14)28-21(29)9-11-26-24(34)25-10-8-15-2-4-16(5-3-15)12-18(22(30)31)23(32)33/h2-7,13,18H,8-12H2,1H3,(H,28,29)(H,30,31)(H,32,33)(H2,25,26,34)

19 October 2016

Identifiers

InChI

1 reference

LDHA Inhibitor, 29 (English)

GADNEHRFYQNKCC-UHFFFAOYSA-N

19 October 2016

InChIKey

1 reference

LDHA Inhibitor, 29 (English)

19 October 2016

1 reference

(4-{2-[({3-[(2-Methyl-1,3-benzothiazol-6-yl)amino]-3-oxopropyl}carbamoyl)amino]ethyl}benzyl)malonic acid (English)

19 October 2016

1 reference

LDHA Inhibitor, 29 (English)

19 October 2016

1 reference

CHEMBL2059807 (English)

19 October 2016

1 reference

0 references

1 reference

4AJN (English)