group E 1682-2106 [PMID:16118363] (Q27077859)

CHEMBL1770295 (English)

3 October 2016

chemical formula

C₁₇H₁₆N₂O₄S₂

1 reference

CHEMBL1770295 (English)

3 October 2016

canonical SMILES

CC(C)C(C(=O)O)N1C(=O)C(=C2C3=CC=CC=C3N(C2=O)C)SC1=S

1 reference

CHEMBL1770295 (English)

3 October 2016

isomeric SMILES

CC(C)C(C(=O)O)N1C(=O)/C(=C/2\C3=CC=CC=C3N(C2=O)C)/SC1=S

1 reference

CHEMBL1770295 (English)

InChI=1S/C17H16N2O4S2/c1-8(2)12(16(22)23)19-15(21)13(25-17(19)24)11-9-6-4-5-7-10(9)18(3)14(11)20/h4-8,12H,1-3H3,(H,22,23)/b13-11-

3 October 2016

Identifiers

InChI

1 reference

CHEMBL1770295 (English)

ICRQMQBVDGOOFY-QBFSEMIESA-N

3 October 2016

InChIKey

1 reference

CHEMBL1770295 (English)

3 October 2016

1 reference

3-Methyl-2-[(5Z)-5-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid (English)

3 October 2016

1 reference

CHEMBL1770295 (English)

3 October 2016

1 reference

Guide to Pharmacology Ligand ID

CHEMBL1770295 (English)

3 October 2016

1 reference

5827

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

5827

group E 1682-2106 [PMID:16118363] (English)