CHEBI:116960 - 2-(6-amino-5-cyano-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoic acid

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ChEBI Name 2-(6-amino-5-cyano-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoic acid ChEBI ID CHEBI:116960 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 C18H12N4O3S Net Charge 0 Average Mass 364.380 Monoisotopic Mass 364.06301 InChI InChI=1S/C18H12N4O3S/c19-8-11-13(9-4-1-2-5-10(9)18(23)24)14-15(12-6-3-7-26-12)21-22-17(14)25-16(11)20/h1-7,13H,20H2,(H,21,22)(H,23,24) InChIKey MBCDSNRTILSULC-UHFFFAOYSA-N SMILES C1=CC=C(C(=C1)C2C(=C(OC3=NNC(=C23)C4=CC=CS4)N)C#N)C(=O)O 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-(6-amino-5-cyano-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoic acid (CHEBI:116960) is a benzoic acids (CHEBI:22723) 2-(6-amino-5-cyano-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoic acid (CHEBI:116960) is a pyranopyrazole (CHEBI:131903) Manual Xref Database LSM-28409 LINCS View more database links Last Modified 11 May 2016