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CHEBI:117173 - 2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-2-phenylacetic acid

ChEBI IDCHEBI:117173
ChEBI Name2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-2-phenylacetic acid
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FormulaC22H18N2O2S2
Net Charge0
Average Mass406.532
Monoisotopic Mass406.08097
SMILESN#Cc1c(SC(C(=O)O)c2ccccc2)nc2c(c1-c1cccs1)CCCC2
InChIInChI=1S/C22H18N2O2S2/c23-13-16-19(18-11-6-12-27-18)15-9-4-5-10-17(15)24-21(16)28-20(22(25)26)14-7-2-1-3-8-14/h1-3,6-8,11-12,20H,4-5,9-10H2,(H,25,26)
InChIKeyJPYKGCKNTOGHKX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-2-phenylacetic acid (CHEBI:117173) is a quinolines (CHEBI:26513)
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