CHEBI:105011 - 2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxylic acid [2-(3-nitroanilino)-2-oxoethyl] ester

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ChEBI Name 2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxylic acid [2-(3-nitroanilino)-2-oxoethyl] ester ChEBI ID CHEBI:105011 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 C22H16N4O5S Net Charge 0 Average Mass 448.453 Monoisotopic Mass 448.08414 InChI InChI=1S/C22H16N4O5S/c27-21(23-15-6-4-9-17(12-15)26(29)30)14-31-22(28)19-13-18(20-10-5-11-32-20)24-25(19)16-7-2-1-3-8-16/h1-13H,14H2,(H,23,27) InChIKey VLDPPNRSAGPASZ-UHFFFAOYSA-N SMILES C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)OCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-] ChEBI Ontology Outgoing 2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxylic acid [2-(3-nitroanilino)-2-oxoethyl] ester (CHEBI:105011) is a pyrazoles (CHEBI:26410) 2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxylic acid [2-(3-nitroanilino)-2-oxoethyl] ester (CHEBI:105011) is a ring assembly (CHEBI:36820) Manual Xref Database LSM-16374 LINCS View more database links