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CHEBI:40002 - {3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-1H-indol-1-yl}acetic acid

ChEBI IDCHEBI:40002
ChEBI Name{3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-1H-indol-1-yl}acetic acid
Stars
ASCII Name{3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-1H-indol-1-yl}acetic acid
Last Modified17 October 2009
DownloadsMolfile
FormulaC18H11F3N2O2S
Net Charge0
Average Mass376.359
Monoisotopic Mass376.04933
SMILES[H]OC(=O)C([H])([H])n1c([H])c(C([H])([H])c2nc3c(F)c(F)c([H])c(F)c3s2)c2c([H])c([H])c([H])c([H])c21
InChIInChI=1S/C18H11F3N2O2S/c19-11-6-12(20)18-17(16(11)21)22-14(26-18)5-9-7-23(8-15(24)25)13-4-2-1-3-10(9)13/h1-4,6-7H,5,8H2,(H,24,25)
InChIKeyKYHVTMFADJNSGS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
{3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-1H-indol-1-yl}acetic acid (CHEBI:40002) is a benzothiazoles (CHEBI:37947)
{3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-1H-indol-1-yl}acetic acid (CHEBI:40002) is a indolyl carboxylic acid (CHEBI:46867)
{3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-1H-indol-1-yl}acetic acid (CHEBI:40002) is a organofluorine compound (CHEBI:37143)
Synonyms  Source
{3-[(4,5,7-TRIFLUORO-1,3-BENZOTHIAZOL-2-YL)METHYL]-1H-INDOL-1-YL}ACETIC ACIDPDBeChem
{3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-1H-indol-1-yl}acetic acidPDBeChem
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