CHEBI:116744 - 2-chloro-5-[[1-oxo-2-[(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)thio]ethyl]amino]benzoic acid

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ChEBI Name 2-chloro-5-[[1-oxo-2-[(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)thio]ethyl]amino]benzoic acid ChEBI ID CHEBI:116744 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C16H11ClN4O3S2 Net Charge 0 Average Mass 406.869 Monoisotopic Mass 405.99611 InChI InChI=1S/C16H11ClN4O3S2/c17-12-2-1-10(7-11(12)15(23)24)19-13(22)8-25-16-21-20-14(26-16)9-3-5-18-6-4-9/h1-7H,8H2,(H,19,22)(H,23,24) InChIKey IPWPZEUDOVPHLI-UHFFFAOYSA-N SMILES C1=CC(=C(C=C1NC(=O)CSC2=NN=C(S2)C3=CC=NC=C3)C(=O)O)Cl Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 2-chloro-5-[[1-oxo-2-[(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)thio]ethyl]amino]benzoic acid (CHEBI:116744) is a amidobenzoic acid (CHEBI:48470) Manual Xref Database LSM-28196 LINCS View more database links