1-methyl-5-phenyl-4-[(E)-C-phenyl-N-(pyridin-2-ylamino)carbonimidoyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-methyl-5-phenyl-4-[(E)-C-phenyl-N-(pyridin-2-ylamino)carbonimidoyl]pyrazole-3-carboxylic acid Openeye Name: 1-methyl-5-phenyl-4-[(E)-C-phenyl-N-(2-pyridylamino)carbonimidoyl]pyrazole-3-carboxylic acid CAS Name: 1-methyl-5-phenyl-4-[(E)-phenyl-(2-pyridinylhydrazinylidene)methyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-phenyl-4-[(E)-C-phenyl-N-(pyridin-2-ylamino)carbonimidoyl]pyrazole-3-carboxylic acid Traditional Name: 1-methyl-5-phenyl-4-[(E)-C-phenyl-N-(2-pyridylamino)carbonimidoyl]pyrazole-3-carboxylic acid Formula: C23H19N5O2 MolecularWeight: 397.42926

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(=O)O)C(=NNC2=CC=CC=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C(=N1)C(=O)O)/C(=N/NC2=CC=CC=N2)/C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H19N5O2/c1-28-22(17-12-6-3-7-13-17)19(21(27-28)23(29)30)20(16-10-4-2-5-11-16)26-25-18-14-8-9-15-24-18/h2-15H,1H3,(H,24,25)(H,29,30)/b26-20+