5-(3-ethyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-(3-ethyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-[3-ethyl-5-(4-pyridyl)-1,2,4-triazol-4-yl]-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 5-(3-ethyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 5-(3-ethyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-[3-ethyl-5-(4-pyridyl)-1,2,4-triazol-4-yl]-1-phenyl-pyrazole-4-carboxylic acid Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=C(C=NN2C3=CC=CC=C3)C(=O)O)C4=CC=NC=C4

Isomeric SMILES

CCC1=NN=C(N1C2=C(C=NN2C3=CC=CC=C3)C(=O)O)C4=CC=NC=C4

InChI

InChI=1S/C19H16N6O2/c1-2-16-22-23-17(13-8-10-20-11-9-13)24(16)18-15(19(26)27)12-21-25(18)14-6-4-3-5-7-14/h3-12H,2H2,1H3,(H,26,27)